N-(2-aminocyclopropyl)naphthalene-1-carboxamide

C14H14N2O — CID 43593836

IUPACN-(2-aminocyclopropyl)naphthalene-1-carboxamide
SMILESNC1CC1NC(=O)c1cccc2ccccc12
InChIInChI=1S/C14H14N2O/c15-12-8-13(12)16-14(17)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-13H,8,15H2,(H,16,17)
InChIKeyYXHSLUFPEBLKKX-UHFFFAOYSA-N
MW226.28 g/mol
LogP1.67
Rot. Bonds2

About N-(2-aminocyclopropyl)naphthalene-1-carboxamide

N-(2-aminocyclopropyl)naphthalene-1-carboxamide (PubChem CID 43593836) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is N-(2-aminocyclopropyl)naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-(2-aminocyclopropyl)naphthalene-1-carboxamide
PubChem CID43593836
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC NameN-(2-aminocyclopropyl)naphthalene-1-carboxamide
SMILESNC1CC1NC(=O)c1cccc2ccccc12
InChIInChI=1S/C14H14N2O/c15-12-8-13(12)16-14(17)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-13H,8,15H2,(H,16,17)
InChIKeyYXHSLUFPEBLKKX-UHFFFAOYSA-N
XLogP1.67
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminocyclopropyl)-2-methylbenzamide
CID 43593725
N-(2-aminocyclopropyl)quinoline-8-carboxamide
CID 62875389
N-[4-(2-aminocyclopropyl)phenyl]naphthalene-1-carboxamide;hydrochloride
CID 170691820
N-(2-amino-4-ethoxycyclobutyl)naphthalene-1-carboxamide
CID 66194914
N-[(2-aminocyclohexyl)methyl]naphthalene-1-carboxamide
CID 64928625
N-(2-chloro-4-methylidenecyclohexyl)naphthalene-1-carboxamide
CID 91046482
N-[(3S)-pyrrolidin-3-yl]naphthalene-1-carboxamide
CID 79689471
N-[(1R,5S)-3,3,5-trimethylcyclohexyl]naphthalene-1-carboxamide
CID 1206106
N-[(3-aminocyclohexyl)methyl]naphthalene-1-carboxamide
CID 106123070
N-[1-(naphthalene-1-carbonyl)piperidin-4-yl]naphthalene-1-carboxamide
CID 108554043
1-hydroxy-N-(2-methylcyclopropyl)naphthalene-2-carboxamide
CID 62408035
N-[(3S,4R)-1,1-dioxo-4-piperidin-1-ylthiolan-3-yl]naphthalene-1-carboxamide
CID 97017849

Frequently Asked Questions

What is the IUPAC name of N-(2-aminocyclopropyl)naphthalene-1-carboxamide?
The IUPAC name of N-(2-aminocyclopropyl)naphthalene-1-carboxamide (CID 43593836) is N-(2-aminocyclopropyl)naphthalene-1-carboxamide.
What is the SMILES notation for N-(2-aminocyclopropyl)naphthalene-1-carboxamide?
The canonical SMILES for N-(2-aminocyclopropyl)naphthalene-1-carboxamide is NC1CC1NC(=O)c1cccc2ccccc12.
What is the InChIKey of N-(2-aminocyclopropyl)naphthalene-1-carboxamide?
The InChIKey is YXHSLUFPEBLKKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c15-12-8-13(12)16-14(17)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12-13H,8,15H2,(H,16,17).
What are the key properties of N-(2-aminocyclopropyl)naphthalene-1-carboxamide?
N-(2-aminocyclopropyl)naphthalene-1-carboxamide has a molecular weight of 226.28 g/mol, XLogP of 1.67, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminocyclopropyl)naphthalene-1-carboxamide is sourced from PubChem (CID 43593836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).