2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide

C12H24N2O2 — CID 76934435

IUPAC2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide
SMILESCOC1CCCC1NC(=O)C(N)C(C)(C)C
InChIInChI=1S/C12H24N2O2/c1-12(2,3)10(13)11(15)14-8-6-5-7-9(8)16-4/h8-10H,5-7,13H2,1-4H3,(H,14,15)
InChIKeyVUJCVARONPKJPM-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.04
Rot. Bonds3

About 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide

2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide (PubChem CID 76934435) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide.

Molecular Properties

Compound Name2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide
PubChem CID76934435
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide
SMILESCOC1CCCC1NC(=O)C(N)C(C)(C)C
InChIInChI=1S/C12H24N2O2/c1-12(2,3)10(13)11(15)14-8-6-5-7-9(8)16-4/h8-10H,5-7,13H2,1-4H3,(H,14,15)
InChIKeyVUJCVARONPKJPM-UHFFFAOYSA-N
XLogP1.04
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2s,3s)-2-amino-3-methyl-N-((tetrahydrofuran-2-yl)methyl)pentanamide
CID 61148967
2-amino-3,3,3-trifluoro-N-(2-methoxycyclopentyl)-2-methylpropanamide
CID 79812211
2-[(2-methoxycyclopentyl)amino]-N-(2,2,2-trifluoroethyl)propanamide
CID 116153404
(2S)-2-amino-4-methyl-N-[[(2S)-oxolan-2-yl]methyl]pentanamide
CID 28202306
(2S)-2-amino-4-methyl-N-[[(2R)-oxolan-2-yl]methyl]pentanamide
CID 28202310
(2R)-2-amino-3-methyl-N-[[(2R)-oxolan-2-yl]methyl]butanamide
CID 28209111
CID 57880758
CID 57880758
(2R)-2-amino-3-methyl-N-(oxolan-2-ylmethyl)butanamide
CID 59254540
2-acetamido-3-methyl-N-(oxolan-2-ylmethyl)butanamide
CID 60414496
(2S)-2-amino-4-methyl-N-(oxolan-2-ylmethyl)pentanamide
CID 61148964
2-amino-N-(2-hydroxycyclopentyl)-3,3-dimethylbutanamide
CID 68918226
2-amino-3,3-dimethyl-N-(oxolan-2-ylmethyl)butanamide
CID 68920784

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide?
The IUPAC name of 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide (CID 76934435) is 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide.
What is the SMILES notation for 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide?
The canonical SMILES for 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide is COC1CCCC1NC(=O)C(N)C(C)(C)C.
What is the InChIKey of 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide?
The InChIKey is VUJCVARONPKJPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-12(2,3)10(13)11(15)14-8-6-5-7-9(8)16-4/h8-10H,5-7,13H2,1-4H3,(H,14,15).
What are the key properties of 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide?
2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide has a molecular weight of 228.34 g/mol, XLogP of 1.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-methoxycyclopentyl)-3,3-dimethylbutanamide is sourced from PubChem (CID 76934435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).