2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide

C12H24N2O2 — CID 82768546

IUPAC2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide
SMILESCC(C)C(CO)NC(=O)C1(C)CCCC1N
InChIInChI=1S/C12H24N2O2/c1-8(2)9(7-15)14-11(16)12(3)6-4-5-10(12)13/h8-10,15H,4-7,13H2,1-3H3,(H,14,16)
InChIKeyYKXXHYOXCJSXCZ-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.64
Rot. Bonds4

About 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide

2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide (PubChem CID 82768546) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide
PubChem CID82768546
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide
SMILESCC(C)C(CO)NC(=O)C1(C)CCCC1N
InChIInChI=1S/C12H24N2O2/c1-8(2)9(7-15)14-11(16)12(3)6-4-5-10(12)13/h8-10,15H,4-7,13H2,1-3H3,(H,14,16)
InChIKeyYKXXHYOXCJSXCZ-UHFFFAOYSA-N
XLogP0.64
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-methyl-N-(4-methylpentan-2-yl)cyclopentane-1-carboxamide
CID 82763758
3-[(2-amino-1-methylcyclopentanecarbonyl)amino]butanoic acid
CID 82768685
4-amino-N-(1-hydroxy-3-methylbutan-2-yl)-3-methyloxolane-3-carboxamide
CID 79249257
2-amino-N-(1-cyclohexylethyl)-1-methylcyclopentane-1-carboxamide
CID 82768064
2-amino-N-(2,3-dihydroxypropyl)-1-methylcyclopentane-1-carboxamide
CID 82768544
2-amino-1-methyl-N-(4-phenylbutan-2-yl)cyclopentane-1-carboxamide
CID 82767340
2-amino-N-(3-ethylpentan-3-yl)-1-methylcyclopentane-1-carboxamide
CID 82767363
2-amino-N-[3-(hydroxymethyl)pentan-3-yl]-1-methylcyclopentane-1-carboxamide
CID 82768610
1-(2-amino-1-methylcyclopentyl)-3-methylbutan-1-one
CID 116607171
2-amino-N-(cyanomethyl)-1-methylcyclopentane-1-carboxamide
CID 82767784
1-(aminomethyl)-N-[(2S)-1-hydroxy-3-methylbutan-2-yl]cyclohexane-1-carboxamide
CID 115438007
2-[(2-amino-1-methylcyclopentanecarbonyl)amino]-4-methylsulfonylbutanoic acid
CID 82767680

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide (CID 82768546) is 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide is CC(C)C(CO)NC(=O)C1(C)CCCC1N.
What is the InChIKey of 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide?
The InChIKey is YKXXHYOXCJSXCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-8(2)9(7-15)14-11(16)12(3)6-4-5-10(12)13/h8-10,15H,4-7,13H2,1-3H3,(H,14,16).
What are the key properties of 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide?
2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide has a molecular weight of 228.34 g/mol, XLogP of 0.64, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(1-hydroxy-3-methylbutan-2-yl)-1-methylcyclopentane-1-carboxamide is sourced from PubChem (CID 82768546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).