N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine

C18H21N5 — CID 95862380

IUPACN-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(N[C@H](c2cc(C)ccn2)C2CC2)n2nccc2n1
InChIInChI=1S/C18H21N5/c1-3-14-11-17(23-16(21-14)7-9-20-23)22-18(13-4-5-13)15-10-12(2)6-8-19-15/h6-11,13,18,22H,3-5H2,1-2H3/t18-/m0/s1
InChIKeyFBBVOAVQVWKLBR-SFHVURJKSA-N
MW307.40 g/mol
LogP3.56
Rot. Bonds5

About N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine

N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine (PubChem CID 95862380) has the molecular formula C18H21N5 and a molecular weight of 307.40 g/mol. Its IUPAC name is N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine
PubChem CID95862380
Molecular FormulaC18H21N5
Molecular Weight307.40 g/mol
Exact Mass307.18
IUPAC NameN-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine
SMILESCCc1cc(N[C@H](c2cc(C)ccn2)C2CC2)n2nccc2n1
InChIInChI=1S/C18H21N5/c1-3-14-11-17(23-16(21-14)7-9-20-23)22-18(13-4-5-13)15-10-12(2)6-8-19-15/h6-11,13,18,22H,3-5H2,1-2H3/t18-/m0/s1
InChIKeyFBBVOAVQVWKLBR-SFHVURJKSA-N
XLogP3.56
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.40
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-2-methylsulfanylacetamide
CID 125436602
(3R)-3-[(5-ethylpyrazolo[1,5-a]pyrimidin-7-yl)amino]azepan-2-one
CID 95718361
N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-2-methyl-6-piperidin-4-ylpyrimidin-4-amine
CID 95222261
N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-2-(methylamino)acetamide
CID 95554873
5-ethyl-N-(pyridin-4-ylmethyl)pyrazolo[1,5-a]pyrimidin-7-amine
CID 56890779
N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]furan-3-carboxamide
CID 125444561
N-[1-(1,1-dioxothian-4-yl)piperidin-4-yl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine
CID 56895664
N-[(1R)-1-(2,4-difluorophenyl)ethyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine
CID 95870096
N-[cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-methyl-1,3-oxazole-4-carboxamide
CID 122561176
1-cyclohexyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 63839255
1-cycloheptyl-N-methyl-1-(4-methyl-2-pyridinyl)methanamine
CID 82932487
1-cyclohexyl-N-[(R)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]piperidine-4-carboxamide
CID 97204702

Frequently Asked Questions

What is the IUPAC name of N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine (CID 95862380) is N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine is CCc1cc(N[C@H](c2cc(C)ccn2)C2CC2)n2nccc2n1.
What is the InChIKey of N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is FBBVOAVQVWKLBR-SFHVURJKSA-N. The full InChI is InChI=1S/C18H21N5/c1-3-14-11-17(23-16(21-14)7-9-20-23)22-18(13-4-5-13)15-10-12(2)6-8-19-15/h6-11,13,18,22H,3-5H2,1-2H3/t18-/m0/s1.
What are the key properties of N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine?
N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 307.40 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(S)-cyclopropyl-(4-methyl-2-pyridinyl)methyl]-5-ethylpyrazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 95862380), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).