N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide

C16H18N2O — CID 65188485

IUPACN-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide
SMILESNCC(NC(=O)c1cccc2ccccc12)C1CC1
InChIInChI=1S/C16H18N2O/c17-10-15(12-8-9-12)18-16(19)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,12,15H,8-10,17H2,(H,18,19)
InChIKeyPURHGDNJYUSXJJ-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.31
Rot. Bonds4

About N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide

N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide (PubChem CID 65188485) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide
PubChem CID65188485
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC NameN-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide
SMILESNCC(NC(=O)c1cccc2ccccc12)C1CC1
InChIInChI=1S/C16H18N2O/c17-10-15(12-8-9-12)18-16(19)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,12,15H,8-10,17H2,(H,18,19)
InChIKeyPURHGDNJYUSXJJ-UHFFFAOYSA-N
XLogP2.31
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-amino-1-cyclopropylethyl)-2-chlorobenzamide
CID 65188374
N-(2-amino-1-cyclopropylethyl)-2-fluorobenzamide
CID 65188796
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CID 119615422
N-(2-amino-1-cyclopropylethyl)-2-methylsulfanylbenzamide;hydrochloride
CID 119614072
N-(2-amino-1-cyclopropylethyl)-2-methoxybenzamide
CID 65188794
N-(2-amino-1-cyclopropylethyl)-2-ethoxy-3-fluorobenzamide
CID 119613240
N-(2-amino-1-cyclopentylethyl)quinoline-5-carboxamide
CID 106737604
N-(2-amino-1-cyclopropylethyl)naphthalene-2-carboxamide
CID 65189109
N-(2-amino-1-cyclopropylethyl)-2-nitrobenzamide
CID 65188581
N-(2-amino-1-cyclopropylethyl)-2-(trifluoromethyl)benzamide;hydrochloride
CID 86813170
N-(2-amino-1-cyclohexylethyl)-2-chlorobenzamide
CID 81487183
N-(2-amino-1-cyclopropyl-2-hydroxyiminoethyl)naphthalene-1-carboxamide
CID 77038961

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide?
The IUPAC name of N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide (CID 65188485) is N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide?
The canonical SMILES for N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide is NCC(NC(=O)c1cccc2ccccc12)C1CC1.
What is the InChIKey of N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide?
The InChIKey is PURHGDNJYUSXJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c17-10-15(12-8-9-12)18-16(19)14-7-3-5-11-4-1-2-6-13(11)14/h1-7,12,15H,8-10,17H2,(H,18,19).
What are the key properties of N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide?
N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide has a molecular weight of 254.33 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-1-cyclopropylethyl)naphthalene-1-carboxamide is sourced from PubChem (CID 65188485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).