N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide

C15H26N4O — CID 119603106

IUPACN-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
SMILESCc1nn(C)c(C)c1CCC(=O)NC1CCCC1CN
InChIInChI=1S/C15H26N4O/c1-10-13(11(2)19(3)18-10)7-8-15(20)17-14-6-4-5-12(14)9-16/h12,14H,4-9,16H2,1-3H3,(H,17,20)
InChIKeyKWWQHNFWZYIVCX-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.21
Rot. Bonds5

About N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide

N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide (PubChem CID 119603106) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide.

Molecular Properties

Compound NameN-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
PubChem CID119603106
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC NameN-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
SMILESCc1nn(C)c(C)c1CCC(=O)NC1CCCC1CN
InChIInChI=1S/C15H26N4O/c1-10-13(11(2)19(3)18-10)7-8-15(20)17-14-6-4-5-12(14)9-16/h12,14H,4-9,16H2,1-3H3,(H,17,20)
InChIKeyKWWQHNFWZYIVCX-UHFFFAOYSA-N
XLogP1.21
TPSA72.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(aminomethyl)cyclohexyl]-2-methyl-3-(1,3,5-trimethylpyrazol-4-yl)propanamide;dihydrochloride
CID 119612567
N-[2-(aminomethyl)cyclohexyl]-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
CID 119610269
N-[(3S,4R)-1-(2-amino-2-oxoethyl)-4-cyclopropylpyrrolidin-3-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 133113348
N-[2-(aminomethyl)cyclopentyl]-3-(2,4-dimethylpyrimido[1,2-b]indazol-3-yl)propanamide;hydrochloride
CID 119603111
N-[(3S,4R)-3-hydroxyoxan-4-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 91785336
N-(1-aminopropan-2-yl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 110834085
N-(3-ethylsulfanylcyclohexyl)-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 71979348
N-[2-(aminomethyl)cyclohexyl]-3-(1,4,6-trimethyl-3-oxo-2H-pyrazolo[3,4-b]pyridin-5-yl)propanamide;dihydrochloride
CID 119611977
N-[(3S)-1,1-dioxo-2,3-dihydrothiophen-3-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 96577638
N-[(2S)-butan-2-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide
CID 94532619
N-[2-(aminomethyl)cyclopentyl]pentanamide
CID 62957090
N-[(3R,4S)-4-cyclopropyl-1-(3-methylbut-2-enyl)pyrrolidin-3-yl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide;hydrochloride
CID 154898039

Frequently Asked Questions

What is the IUPAC name of N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide?
The IUPAC name of N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide (CID 119603106) is N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide.
What is the SMILES notation for N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide?
The canonical SMILES for N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide is Cc1nn(C)c(C)c1CCC(=O)NC1CCCC1CN.
What is the InChIKey of N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide?
The InChIKey is KWWQHNFWZYIVCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-10-13(11(2)19(3)18-10)7-8-15(20)17-14-6-4-5-12(14)9-16/h12,14H,4-9,16H2,1-3H3,(H,17,20).
What are the key properties of N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide?
N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide has a molecular weight of 278.40 g/mol, XLogP of 1.21, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(aminomethyl)cyclopentyl]-3-(1,3,5-trimethylpyrazol-4-yl)propanamide is sourced from PubChem (CID 119603106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).