2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide

C13H26N2O — CID 82763758

IUPAC2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide
SMILESCC(C)CC(C)NC(=O)C1(C)CCCC1N
InChIInChI=1S/C13H26N2O/c1-9(2)8-10(3)15-12(16)13(4)7-5-6-11(13)14/h9-11H,5-8,14H2,1-4H3,(H,15,16)
InChIKeyJHWQIZBZSJRQPN-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.05
Rot. Bonds4

About 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide

2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide (PubChem CID 82763758) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide
PubChem CID82763758
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide
SMILESCC(C)CC(C)NC(=O)C1(C)CCCC1N
InChIInChI=1S/C13H26N2O/c1-9(2)8-10(3)15-12(16)13(4)7-5-6-11(13)14/h9-11H,5-8,14H2,1-4H3,(H,15,16)
InChIKeyJHWQIZBZSJRQPN-UHFFFAOYSA-N
XLogP2.05
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(2-amino-1-methylcyclopentanecarbonyl)amino]butanoic acid
CID 82768685
2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide
CID 82768546
3-[[(2-amino-1-methylcyclopentanecarbonyl)amino]methyl]-5-methylhexanoic acid
CID 82768358
2-amino-1-methyl-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide
CID 82767340
2-amino-N-(1-cyclohexylethyl)-1-methylcyclopentane-1-carboxamide
CID 82768064
1-(2-amino-1-methylcyclopentyl)-3-methylbutan-1-one
CID 116607171
2-amino-N-(3-ethylpentan-3-yl)-1-methylcyclopentane-1-carboxamide
CID 82767363
2-amino-N-(cyanomethyl)-1-methylcyclopentane-1-carboxamide
CID 82767784
2-[(2-amino-1-methylcyclopentanecarbonyl)amino]-4-methylsulfonylbutanoic acid
CID 82767680
3-[(2-amino-1-methylcyclopentanecarbonyl)amino]-3-phenylpropanoic acid
CID 82759479
2-amino-N-(2,3-dihydroxypropyl)-1-methylcyclopentane-1-carboxamide
CID 82768544
(2S)-2-[(2-amino-1-methylcyclopentanecarbonyl)amino]-3-phenylpropanoic acid
CID 82758703

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide (CID 82763758) is 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide is CC(C)CC(C)NC(=O)C1(C)CCCC1N.
What is the InChIKey of 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide?
The InChIKey is JHWQIZBZSJRQPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-9(2)8-10(3)15-12(16)13(4)7-5-6-11(13)14/h9-11H,5-8,14H2,1-4H3,(H,15,16).
What are the key properties of 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide?
2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide has a molecular weight of 226.36 g/mol, XLogP of 2.05, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 82763758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).