N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C20H22N4O — CID 37153510

IUPACN,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(C)n2ncc(C(=O)N(C)[C@@H]3CCCc4ccccc43)c2n1
InChIInChI=1S/C20H22N4O/c1-13-11-14(2)24-19(22-13)17(12-21-24)20(25)23(3)18-10-6-8-15-7-4-5-9-16(15)18/h4-5,7,9,11-12,18H,6,8,10H2,1-3H3/t18-/m1/s1
InChIKeyCCKYCDIDPGJTCQ-GOSISDBHSA-N
MW334.42 g/mol
LogP3.50
Rot. Bonds2

About N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 37153510) has the molecular formula C20H22N4O and a molecular weight of 334.42 g/mol. Its IUPAC name is N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

Compound NameN,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
PubChem CID37153510
Molecular FormulaC20H22N4O
Molecular Weight334.42 g/mol
Exact Mass334.18
IUPAC NameN,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
SMILESCc1cc(C)n2ncc(C(=O)N(C)[C@@H]3CCCc4ccccc43)c2n1
InChIInChI=1S/C20H22N4O/c1-13-11-14(2)24-19(22-13)17(12-21-24)20(25)23(3)18-10-6-8-15-7-4-5-9-16(15)18/h4-5,7,9,11-12,18H,6,8,10H2,1-3H3/t18-/m1/s1
InChIKeyCCKYCDIDPGJTCQ-GOSISDBHSA-N
XLogP3.50
TPSA50.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.42
LogP ≤ 53.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N,2-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 134791703
6-(2-hydroxyethyl)-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 74233515
N,6-dimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyridine-3-carboxamide
CID 31121176
N,6-dimethyl-2-oxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1H-pyridine-3-carboxamide
CID 86768777
N,4-dimethyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)benzamide
CID 42884040
N-(2,3-dihydro-1H-inden-1-yl)-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 42946251
N-[(1S)-2,3-dihydro-1H-inden-1-yl]-N-methylpyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 39977135
N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyridine-4-carboxamide
CID 42916496
2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide
CID 51190736
5-chloro-N-methyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrazine-2-carboxamide
CID 107371805
N,2-dimethyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-4,5,6,7-tetrahydroindazole-3-carboxamide
CID 96576738
3-chloro-N,6-dimethyl-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 97124608

Frequently Asked Questions

What is the IUPAC name of N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The IUPAC name of N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 37153510) is N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.
What is the SMILES notation for N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The canonical SMILES for N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1cc(C)n2ncc(C(=O)N(C)[C@@H]3CCCc4ccccc43)c2n1.
What is the InChIKey of N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
The InChIKey is CCKYCDIDPGJTCQ-GOSISDBHSA-N. The full InChI is InChI=1S/C20H22N4O/c1-13-11-14(2)24-19(22-13)17(12-21-24)20(25)23(3)18-10-6-8-15-7-4-5-9-16(15)18/h4-5,7,9,11-12,18H,6,8,10H2,1-3H3/t18-/m1/s1.
What are the key properties of N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?
N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 334.42 g/mol, XLogP of 3.50, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,5,7-trimethyl-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 37153510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).