2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide

C14H28N2O2 — CID 141416123

IUPAC2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide
SMILESCON(C)C(=O)C(CC1CCCC1)NC(C)(C)C
InChIInChI=1S/C14H28N2O2/c1-14(2,3)15-12(13(17)16(4)18-5)10-11-8-6-7-9-11/h11-12,15H,6-10H2,1-5H3
InChIKeySQYVIGAYSMXMFQ-UHFFFAOYSA-N
MW256.39 g/mol
LogP2.34
Rot. Bonds5

About 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide

2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide (PubChem CID 141416123) has the molecular formula C14H28N2O2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide.

Molecular Properties

Compound Name2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide
PubChem CID141416123
Molecular FormulaC14H28N2O2
Molecular Weight256.39 g/mol
Exact Mass256.22
IUPAC Name2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide
SMILESCON(C)C(=O)C(CC1CCCC1)NC(C)(C)C
InChIInChI=1S/C14H28N2O2/c1-14(2,3)15-12(13(17)16(4)18-5)10-11-8-6-7-9-11/h11-12,15H,6-10H2,1-5H3
InChIKeySQYVIGAYSMXMFQ-UHFFFAOYSA-N
XLogP2.34
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[3-cyclohexyl-1-[methoxy(methyl)amino]-1-oxopropan-2-yl]pyridine-2-carboxamide
CID 134996985
methyl 3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
CID 4264602
tert-butyl N-[3-cyclobutyl-1-(dimethylamino)-1-oxopropan-2-yl]carbamate
CID 58987170
4-(tert-butylamino)-6-cyclopentyl-2,2-dimethylhexan-3-one;methane
CID 161063092
3-(tert-butylamino)-4-cyclobutyl-N-ethyl-2-oxobutanamide
CID 58331760
tert-butyl-[3-cyclopropyl-1-[methoxy(methyl)amino]-1-oxopropan-2-yl]carbamic acid
CID 174185990
methyl 2-(cyclohexylmethyl)-3-hydroxy-3-methylbutanoate
CID 164683725
dimethyl 2-(cyclohexylmethyl)propanedioate
CID 22460415
2-cyclopentyl-N-methoxy-N-methylacetamide
CID 15158208
2-(tert-butylamino)-1-(3,3-dimethylcyclohexyl)-4,4-dimethylpentan-3-one
CID 22972943
(2R)-3-cyclohexyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
CID 2755927
(2S)-2-(tert-butylamino)-4-cyclohexylbutanamide
CID 122595251

Frequently Asked Questions

What is the IUPAC name of 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide?
The IUPAC name of 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide (CID 141416123) is 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide.
What is the SMILES notation for 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide?
The canonical SMILES for 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide is CON(C)C(=O)C(CC1CCCC1)NC(C)(C)C.
What is the InChIKey of 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide?
The InChIKey is SQYVIGAYSMXMFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2/c1-14(2,3)15-12(13(17)16(4)18-5)10-11-8-6-7-9-11/h11-12,15H,6-10H2,1-5H3.
What are the key properties of 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide?
2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide has a molecular weight of 256.39 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tert-butylamino)-3-cyclopentyl-N-methoxy-N-methylpropanamide is sourced from PubChem (CID 141416123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).