(2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide

C14H21N5O — CID 125444459

IUPAC(2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide
SMILESCCCn1ccnc1CNC(=O)[C@@H](C)n1cc(C)cn1
InChIInChI=1S/C14H21N5O/c1-4-6-18-7-5-15-13(18)9-16-14(20)12(3)19-10-11(2)8-17-19/h5,7-8,10,12H,4,6,9H2,1-3H3,(H,16,20)/t12-/m1/s1
InChIKeyUQWCTMCNNRLBPA-GFCCVEGCSA-N
MW275.36 g/mol
LogP1.68
Rot. Bonds6

About (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide

(2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide (PubChem CID 125444459) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide.

Molecular Properties

Compound Name(2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide
PubChem CID125444459
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC Name(2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide
SMILESCCCn1ccnc1CNC(=O)[C@@H](C)n1cc(C)cn1
InChIInChI=1S/C14H21N5O/c1-4-6-18-7-5-15-13(18)9-16-14(20)12(3)19-10-11(2)8-17-19/h5,7-8,10,12H,4,6,9H2,1-3H3,(H,16,20)/t12-/m1/s1
InChIKeyUQWCTMCNNRLBPA-GFCCVEGCSA-N
XLogP1.68
TPSA64.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-2-(4-methylpyrazol-1-yl)propanamide
CID 19534375
N-(furan-2-ylmethyl)-2-(4-methylpyrazol-1-yl)propanamide
CID 19534412
2-methyl-3-morpholin-4-yl-N-[(1-propylimidazol-2-yl)methyl]propanamide
CID 122570107
ethyl (2R)-2-(4-methylpyrazol-1-yl)propanoate
CID 7017156
2-(4-methylpyrazol-1-yl)pentan-3-one
CID 64867990
2-(4-methylpyrazol-1-yl)-N-(2,3,4,5,6-pentafluorophenyl)propanamide
CID 19534387
1-(cyclobutanecarbonyl)-N-[(1-propylimidazol-2-yl)methyl]piperidine-4-carboxamide
CID 72857945
2-(azocan-1-yl)-N-[(1-propylimidazol-2-yl)methyl]acetamide
CID 122558206
2-(4-bromopyrazol-1-yl)-N-[(1,5-dimethylpyrazol-4-yl)methyl]propanamide
CID 19537511
1-(1,5-dimethylpyrazol-4-yl)-N-[(1-propylimidazol-2-yl)methyl]ethanamine
CID 62956669
2-(2-methoxyphenyl)-N-[(1-propylimidazol-2-yl)methyl]acetamide
CID 91768236
N-(2,6-dimethylphenyl)-2-(4-methylpyrazol-1-yl)propanamide
CID 19534343

Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide?
The IUPAC name of (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide (CID 125444459) is (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide.
What is the SMILES notation for (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide?
The canonical SMILES for (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide is CCCn1ccnc1CNC(=O)[C@@H](C)n1cc(C)cn1.
What is the InChIKey of (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide?
The InChIKey is UQWCTMCNNRLBPA-GFCCVEGCSA-N. The full InChI is InChI=1S/C14H21N5O/c1-4-6-18-7-5-15-13(18)9-16-14(20)12(3)19-10-11(2)8-17-19/h5,7-8,10,12H,4,6,9H2,1-3H3,(H,16,20)/t12-/m1/s1.
What are the key properties of (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide?
(2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide has a molecular weight of 275.36 g/mol, XLogP of 1.68, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-methylpyrazol-1-yl)-N-[(1-propylimidazol-2-yl)methyl]propanamide is sourced from PubChem (CID 125444459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).