N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide

C12H24N2O — CID 114546265

IUPACN-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide
SMILESCC1CCC(NC(=O)CCNC(C)C)C1
InChIInChI=1S/C12H24N2O/c1-9(2)13-7-6-12(15)14-11-5-4-10(3)8-11/h9-11,13H,4-8H2,1-3H3,(H,14,15)
InChIKeyCCXIRAQHZWYMQW-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.68
Rot. Bonds5

About N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide

N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide (PubChem CID 114546265) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide.

Molecular Properties

Compound NameN-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide
PubChem CID114546265
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide
SMILESCC1CCC(NC(=O)CCNC(C)C)C1
InChIInChI=1S/C12H24N2O/c1-9(2)13-7-6-12(15)14-11-5-4-10(3)8-11/h9-11,13H,4-8H2,1-3H3,(H,14,15)
InChIKeyCCXIRAQHZWYMQW-UHFFFAOYSA-N
XLogP1.68
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-methylcyclohexyl)-4-(propan-2-ylamino)butanamide
CID 60850780
N-cyclopropyl-4-[3-(propan-2-ylamino)propanoylamino]butanamide
CID 79401446
N-(3-methylcyclopentyl)dodecanamide
CID 114549665
3-amino-N-(3-methylcyclopentyl)butanamide
CID 114546157
N-cyclopropyl-2-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394773
3-methyl-N-(3-methylcyclopentyl)pentanamide
CID 114875354
2-amino-N-(3-methylcyclopentyl)acetamide
CID 114546114
4-(methylamino)-N-(3-methylcyclohexyl)butanamide;hydrochloride
CID 119716283
N-cyclopropyl-3-[(3-methylcyclopentyl)methylamino]propanamide
CID 107412683
N-(2,3-dimethylcyclopentyl)-3-(propan-2-ylamino)propanamide
CID 64907400
3-(methanesulfonamido)-N-[(1S,3R)-3-methylcyclohexyl]propanamide
CID 94800013
2-(cyclopentylamino)-N-(3-methylcyclopentyl)acetamide
CID 114546089

Frequently Asked Questions

What is the IUPAC name of N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide?
The IUPAC name of N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide (CID 114546265) is N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide.
What is the SMILES notation for N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide?
The canonical SMILES for N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide is CC1CCC(NC(=O)CCNC(C)C)C1.
What is the InChIKey of N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide?
The InChIKey is CCXIRAQHZWYMQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-9(2)13-7-6-12(15)14-11-5-4-10(3)8-11/h9-11,13H,4-8H2,1-3H3,(H,14,15).
What are the key properties of N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide?
N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide has a molecular weight of 212.34 g/mol, XLogP of 1.68, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylcyclopentyl)-3-(propan-2-ylamino)propanamide is sourced from PubChem (CID 114546265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).