N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride

C14H28ClN3O2 — CID 119567720

IUPACN-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride
SMILESCC(NC(=O)C(C)(C)C)C(=O)NC1(CN)CCCC1.Cl
InChIInChI=1S/C14H27N3O2.ClH/c1-10(16-12(19)13(2,3)4)11(18)17-14(9-15)7-5-6-8-14;/h10H,5-9,15H2,1-4H3,(H,16,19)(H,17,18);1H
InChIKeyZGGQCXRUGCECSG-UHFFFAOYSA-N
MW305.85 g/mol
LogP1.35
Rot. Bonds4

About N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride

N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride (PubChem CID 119567720) has the molecular formula C14H28ClN3O2 and a molecular weight of 305.85 g/mol. Its IUPAC name is N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride.

Molecular Properties

Compound NameN-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride
PubChem CID119567720
Molecular FormulaC14H28ClN3O2
Molecular Weight305.85 g/mol
Exact Mass305.19
IUPAC NameN-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride
SMILESCC(NC(=O)C(C)(C)C)C(=O)NC1(CN)CCCC1.Cl
InChIInChI=1S/C14H27N3O2.ClH/c1-10(16-12(19)13(2,3)4)11(18)17-14(9-15)7-5-6-8-14;/h10H,5-9,15H2,1-4H3,(H,16,19)(H,17,18);1H
InChIKeyZGGQCXRUGCECSG-UHFFFAOYSA-N
XLogP1.35
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.85
LogP ≤ 51.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[1-[[1-(hydroxymethyl)-3-methylcyclohexyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide
CID 62526681
1-[2-(2,2-dimethylpropanoylamino)propanoylamino]cyclohexane-1-carboxylic acid
CID 43358914
N-[2-[[1-(aminomethyl)cyclopentyl]amino]-2-oxoethyl]-2,2-dimethylpropanamide;hydrochloride
CID 119566804
N-[1-(aminomethyl)cyclohexyl]-2-methylbutanamide
CID 63756005
N-[1-(aminomethyl)cyclopentyl]-3,3-dimethylbutanamide;hydrochloride
CID 119565263
N-[1-(aminomethyl)cyclohexyl]-2-methylpentanamide
CID 63755495
2-methylpropyl N-[1-(aminomethyl)cyclopentyl]carbamate
CID 63766538
N-[1-[(1-amino-2-cyclopropylpropan-2-yl)amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride
CID 119575220
N-[1-(aminomethyl)cyclopentyl]-2-(carbamoylamino)hexanamide;hydrochloride
CID 119565556
N-[1-(aminomethyl)-3-methylcyclohexyl]-2-methylpropanamide
CID 63753681
N-(1-ethylcyclopentyl)-2,2-dimethylpropanamide
CID 58542277
N-[1-(aminomethyl)cyclopentyl]-2-[(1-methylpyrazol-4-yl)sulfonylamino]propanamide;hydrochloride
CID 119568070

Frequently Asked Questions

What is the IUPAC name of N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride?
The IUPAC name of N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride (CID 119567720) is N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride.
What is the SMILES notation for N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride?
The canonical SMILES for N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride is CC(NC(=O)C(C)(C)C)C(=O)NC1(CN)CCCC1.Cl.
What is the InChIKey of N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride?
The InChIKey is ZGGQCXRUGCECSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2.ClH/c1-10(16-12(19)13(2,3)4)11(18)17-14(9-15)7-5-6-8-14;/h10H,5-9,15H2,1-4H3,(H,16,19)(H,17,18);1H.
What are the key properties of N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride?
N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride has a molecular weight of 305.85 g/mol, XLogP of 1.35, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[[1-(aminomethyl)cyclopentyl]amino]-1-oxopropan-2-yl]-2,2-dimethylpropanamide;hydrochloride is sourced from PubChem (CID 119567720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).