1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide

C13H25N3O2 — CID 103108184

IUPAC1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide
SMILESCCN(C)C(=O)C(C)NC(=O)C1(CN)CCCC1
InChIInChI=1S/C13H25N3O2/c1-4-16(3)11(17)10(2)15-12(18)13(9-14)7-5-6-8-13/h10H,4-9,14H2,1-3H3,(H,15,18)
InChIKeyACZYGPVHJXABOT-UHFFFAOYSA-N
MW255.36 g/mol
LogP0.49
Rot. Bonds5

About 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide

1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide (PubChem CID 103108184) has the molecular formula C13H25N3O2 and a molecular weight of 255.36 g/mol. Its IUPAC name is 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide
PubChem CID103108184
Molecular FormulaC13H25N3O2
Molecular Weight255.36 g/mol
Exact Mass255.19
IUPAC Name1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide
SMILESCCN(C)C(=O)C(C)NC(=O)C1(CN)CCCC1
InChIInChI=1S/C13H25N3O2/c1-4-16(3)11(17)10(2)15-12(18)13(9-14)7-5-6-8-13/h10H,4-9,14H2,1-3H3,(H,15,18)
InChIKeyACZYGPVHJXABOT-UHFFFAOYSA-N
XLogP0.49
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 50.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(aminomethyl)-N-[1-(diethylamino)-1-oxopropan-2-yl]cyclohexane-1-carboxamide
CID 115437311
(2R)-2-[[1-(aminomethyl)cyclopentanecarbonyl]amino]propanoic acid
CID 115435215
1-carbamothioyl-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cycloheptane-1-carboxamide
CID 103110390
N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]-3-methylpyrrolidine-3-carboxamide
CID 103109036
1-(aminomethyl)-N-(5-methylhexan-2-yl)cyclohexane-1-carboxamide
CID 63926094
1-(4-aminophenyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopropane-1-carboxamide
CID 103109008
2-[[1-(aminomethyl)cycloheptanecarbonyl]amino]butanoic acid
CID 115443955
1-(aminomethyl)-N-(1-methylsulfonylpropan-2-yl)cyclopentane-1-carboxamide
CID 64631433
1-(aminomethyl)-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]cyclohexane-1-carboxamide
CID 115438007
N-ethyl-2-[(1-hydroxycyclopentyl)methylamino]-N-methylpropanamide
CID 103108861
1-(aminomethyl)-N-(1-oxo-1-piperidin-1-ylpropan-2-yl)cyclobutane-1-carboxamide
CID 115447896
1-(aminomethyl)-N-[4-methyl-1-(methylamino)-1-oxopentan-2-yl]cyclopentane-1-carboxamide
CID 115434776

Frequently Asked Questions

What is the IUPAC name of 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide?
The IUPAC name of 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide (CID 103108184) is 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide?
The canonical SMILES for 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide is CCN(C)C(=O)C(C)NC(=O)C1(CN)CCCC1.
What is the InChIKey of 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide?
The InChIKey is ACZYGPVHJXABOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O2/c1-4-16(3)11(17)10(2)15-12(18)13(9-14)7-5-6-8-13/h10H,4-9,14H2,1-3H3,(H,15,18).
What are the key properties of 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide?
1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide has a molecular weight of 255.36 g/mol, XLogP of 0.49, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(aminomethyl)-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclopentane-1-carboxamide is sourced from PubChem (CID 103108184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).