(2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one

C17H23N5O — CID 97211641

IUPAC(2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one
SMILESCc1cc(C)n([C@H](C)C(=O)N2CCc3c(ncn3C3CC3)C2)n1
InChIInChI=1S/C17H23N5O/c1-11-8-12(2)22(19-11)13(3)17(23)20-7-6-16-15(9-20)18-10-21(16)14-4-5-14/h8,10,13-14H,4-7,9H2,1-3H3/t13-/m1/s1
InChIKeySACOBPMHCBRLRA-CYBMUJFWSA-N
MW313.41 g/mol
LogP2.18
Rot. Bonds3

About (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one

(2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one (PubChem CID 97211641) has the molecular formula C17H23N5O and a molecular weight of 313.41 g/mol. Its IUPAC name is (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one.

Molecular Properties

Compound Name(2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one
PubChem CID97211641
Molecular FormulaC17H23N5O
Molecular Weight313.41 g/mol
Exact Mass313.19
IUPAC Name(2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one
SMILESCc1cc(C)n([C@H](C)C(=O)N2CCc3c(ncn3C3CC3)C2)n1
InChIInChI=1S/C17H23N5O/c1-11-8-12(2)22(19-11)13(3)17(23)20-7-6-16-15(9-20)18-10-21(16)14-4-5-14/h8,10,13-14H,4-7,9H2,1-3H3/t13-/m1/s1
InChIKeySACOBPMHCBRLRA-CYBMUJFWSA-N
XLogP2.18
TPSA55.95 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.41
LogP ≤ 52.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one with MolForge

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Related Compounds

2-(3,5-dimethylpyrazol-1-yl)-1-(2-methyl-4-pyrrolidin-1-yl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-7-yl)propan-1-one
CID 56877518
(3R)-1-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propanoyl]pyrrolidine-3-carboxylic acid
CID 124610502
2-(3,5-dimethylpyrazol-1-yl)-1-(3-hydroxypiperidin-1-yl)propan-1-one
CID 110906659
(2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-phenyl-2-pyrrolidin-1-ylethanone
CID 97185452
(2S)-2-(3,5-dimethylpyrazol-1-yl)-1-[3-(trifluoromethyl)-1,4,6,7-tetrahydropyrazolo[4,3-c]pyridin-5-yl]propan-1-one
CID 95621267
2-[2-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-oxoethyl]-6-methylpyridazin-3-one
CID 75369552
2-(3,5-dimethylpyrazol-1-yl)-1-(4-pyrimidin-2-ylpiperazin-1-yl)propan-1-one
CID 47986482
N-[1-(3,5-dimethylpyrazol-1-yl)propan-2-yl]-1-piperidin-3-yl-6,7-dihydro-4H-imidazo[4,5-c]pyridine-5-carboxamide
CID 167850877
1-(cyclopropylmethyl)-5-[(2R)-2-(3,5-dimethylpyrazol-1-yl)propanoyl]-N-(1,3-thiazol-2-ylmethyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carboxamide
CID 26224035
(2R)-2-(3,5-dimethylpyrazol-1-yl)-1-(2-phenyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl)propan-1-one
CID 95205878
1-[4-(2-aminopyrimidin-4-yl)piperidin-1-yl]-2-(3,5-dimethylpyrazol-1-yl)propan-1-one
CID 86285634
4-[2-(3,5-dimethylpyrazol-1-yl)propanoyl]-N-ethylpiperazine-1-carboxamide
CID 56785284

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one?
The IUPAC name of (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one (CID 97211641) is (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one.
What is the SMILES notation for (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one?
The canonical SMILES for (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one is Cc1cc(C)n([C@H](C)C(=O)N2CCc3c(ncn3C3CC3)C2)n1.
What is the InChIKey of (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one?
The InChIKey is SACOBPMHCBRLRA-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H23N5O/c1-11-8-12(2)22(19-11)13(3)17(23)20-7-6-16-15(9-20)18-10-21(16)14-4-5-14/h8,10,13-14H,4-7,9H2,1-3H3/t13-/m1/s1.
What are the key properties of (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one?
(2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one has a molecular weight of 313.41 g/mol, XLogP of 2.18, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(1-cyclopropyl-6,7-dihydro-4H-imidazo[4,5-c]pyridin-5-yl)-2-(3,5-dimethylpyrazol-1-yl)propan-1-one is sourced from PubChem (CID 97211641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).