N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine

C14H21N5O — CID 95814821

IUPACN,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine
SMILESCc1cc2ncc(CN(C)C)c([C@@H]3CNCCO3)n2n1
InChIInChI=1S/C14H21N5O/c1-10-6-13-16-7-11(9-18(2)3)14(19(13)17-10)12-8-15-4-5-20-12/h6-7,12,15H,4-5,8-9H2,1-3H3/t12-/m0/s1
InChIKeyHSZHNTMSIGRIEC-LBPRGKRZSA-N
MW275.36 g/mol
LogP0.76
Rot. Bonds3

About N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine

N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine (PubChem CID 95814821) has the molecular formula C14H21N5O and a molecular weight of 275.36 g/mol. Its IUPAC name is N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine.

Molecular Properties

Compound NameN,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine
PubChem CID95814821
Molecular FormulaC14H21N5O
Molecular Weight275.36 g/mol
Exact Mass275.17
IUPAC NameN,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine
SMILESCc1cc2ncc(CN(C)C)c([C@@H]3CNCCO3)n2n1
InChIInChI=1S/C14H21N5O/c1-10-6-13-16-7-11(9-18(2)3)14(19(13)17-10)12-8-15-4-5-20-12/h6-7,12,15H,4-5,8-9H2,1-3H3/t12-/m0/s1
InChIKeyHSZHNTMSIGRIEC-LBPRGKRZSA-N
XLogP0.76
TPSA54.69 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.36
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[2-[6-[(dimethylamino)methyl]-2-methylpyrazolo[1,5-a]pyrimidin-7-yl]morpholin-4-yl]ethanol
CID 110094401
2-(1,5-dimethylpyrazol-3-yl)morpholine
CID 82601049
(2S)-2-[5-methyl-2-(4-methylcyclohexyl)pyrazolo[1,5-a]pyrimidin-7-yl]morpholine
CID 169049574
11-methyl-1,4,8,12-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),7,9,11-tetraene
CID 59226017
2-(6-methyl-1H-imidazo[4,5-b]pyridin-2-yl)morpholine
CID 79796200
(2S)-2-[4-[(2-methylpyrimidin-5-yl)methyl]phenyl]morpholine
CID 147724595
(2R)-2-(4-methyl-1,2,4-triazol-3-yl)morpholine
CID 94552518
5-(2,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl)-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole
CID 120959451
(2R)-2-(5-methyl-1H-pyrazol-3-yl)morpholine
CID 96740317
2-(1,4-dimethylpyrazol-3-yl)morpholine
CID 131585478
2-(4-methylpyrimidin-2-yl)morpholine
CID 116901757
2-(3-pentan-3-ylimidazol-4-yl)morpholine
CID 114717268

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine?
The IUPAC name of N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine (CID 95814821) is N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine.
What is the SMILES notation for N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine?
The canonical SMILES for N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine is Cc1cc2ncc(CN(C)C)c([C@@H]3CNCCO3)n2n1.
What is the InChIKey of N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine?
The InChIKey is HSZHNTMSIGRIEC-LBPRGKRZSA-N. The full InChI is InChI=1S/C14H21N5O/c1-10-6-13-16-7-11(9-18(2)3)14(19(13)17-10)12-8-15-4-5-20-12/h6-7,12,15H,4-5,8-9H2,1-3H3/t12-/m0/s1.
What are the key properties of N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine?
N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine has a molecular weight of 275.36 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-1-[2-methyl-7-[(2S)-morpholin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]methanamine is sourced from PubChem (CID 95814821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).