4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride

C19H25ClN2O — CID 119303600

IUPAC4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride
SMILESCC(c1ccc2ccccc2c1)N(C(=O)CCCN)C1CC1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-14(21(18-10-11-18)19(22)7-4-12-20)16-9-8-15-5-2-3-6-17(15)13-16;/h2-3,5-6,8-9,13-14,18H,4,7,10-12,20H2,1H3;1H
InChIKeyMIMNVEGYQFDNTD-UHFFFAOYSA-N
MW332.88 g/mol
LogP4.05
Rot. Bonds6

About 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride

4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride (PubChem CID 119303600) has the molecular formula C19H25ClN2O and a molecular weight of 332.88 g/mol. Its IUPAC name is 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride.

Molecular Properties

Compound Name4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride
PubChem CID119303600
Molecular FormulaC19H25ClN2O
Molecular Weight332.88 g/mol
Exact Mass332.17
IUPAC Name4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride
SMILESCC(c1ccc2ccccc2c1)N(C(=O)CCCN)C1CC1.Cl
InChIInChI=1S/C19H24N2O.ClH/c1-14(21(18-10-11-18)19(22)7-4-12-20)16-9-8-15-5-2-3-6-17(15)13-16;/h2-3,5-6,8-9,13-14,18H,4,7,10-12,20H2,1H3;1H
InChIKeyMIMNVEGYQFDNTD-UHFFFAOYSA-N
XLogP4.05
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.88
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclopropyl-N-[(1S)-1-naphthalen-2-ylethyl]-4-(1,2,4-triazol-1-yl)butanamide
CID 95625443
2-(4-aminophenyl)-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)acetamide
CID 119749324
4-(aminomethyl)-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)benzamide;hydrochloride
CID 119303592
N-cyclopropyl-2-methyl-3-(methylamino)-N-(1-naphthalen-2-ylethyl)propanamide;hydrochloride
CID 119749339
N-cyclopropyl-N-(1-naphthalen-2-ylethyl)-2-(1,2,4-triazol-1-yl)acetamide
CID 51092582
3-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)cyclopentane-1-carboxamide
CID 119749330
3-amino-N-cyclopropyl-N-[(1R)-1-[3-(trifluoromethyl)phenyl]ethyl]propanamide
CID 99849482
2-amino-N-[(1S)-1-(3-chlorophenyl)ethyl]-N-cyclopropylacetamide
CID 96555027
3-[[cyclopropyl-[(1S)-1-naphthalen-2-ylethyl]amino]methyl]benzamide
CID 95043843
4-amino-N-cyclopentyl-N-propan-2-ylbutanamide
CID 119291427
(2R)-3-methyl-2-naphthalen-2-ylbutan-1-amine
CID 121454680
4-amino-N-(cyclobutylmethyl)-N-(1-phenylethyl)butanamide
CID 119332711

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride?
The IUPAC name of 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride (CID 119303600) is 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride.
What is the SMILES notation for 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride?
The canonical SMILES for 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride is CC(c1ccc2ccccc2c1)N(C(=O)CCCN)C1CC1.Cl.
What is the InChIKey of 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride?
The InChIKey is MIMNVEGYQFDNTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O.ClH/c1-14(21(18-10-11-18)19(22)7-4-12-20)16-9-8-15-5-2-3-6-17(15)13-16;/h2-3,5-6,8-9,13-14,18H,4,7,10-12,20H2,1H3;1H.
What are the key properties of 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride?
4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride has a molecular weight of 332.88 g/mol, XLogP of 4.05, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopropyl-N-(1-naphthalen-2-ylethyl)butanamide;hydrochloride is sourced from PubChem (CID 119303600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).