(2-amino-2-naphthalen-1-ylethyl)carbamic acid

C13H14N2O2 — CID 150721997

IUPAC(2-amino-2-naphthalen-1-ylethyl)carbamic acid
SMILESNC(CNC(=O)O)c1cccc2ccccc12
InChIInChI=1S/C13H14N2O2/c14-12(8-15-13(16)17)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12,15H,8,14H2,(H,16,17)
InChIKeyJQAYLMDYSRMEPB-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.11
Rot. Bonds3

About (2-amino-2-naphthalen-1-ylethyl)carbamic acid

(2-amino-2-naphthalen-1-ylethyl)carbamic acid (PubChem CID 150721997) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is (2-amino-2-naphthalen-1-ylethyl)carbamic acid.

Molecular Properties

Compound Name(2-amino-2-naphthalen-1-ylethyl)carbamic acid
PubChem CID150721997
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name(2-amino-2-naphthalen-1-ylethyl)carbamic acid
SMILESNC(CNC(=O)O)c1cccc2ccccc12
InChIInChI=1S/C13H14N2O2/c14-12(8-15-13(16)17)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12,15H,8,14H2,(H,16,17)
InChIKeyJQAYLMDYSRMEPB-UHFFFAOYSA-N
XLogP2.11
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.11
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

(2-amino-2-phenylethyl)carbamic acid
CID 66941802
propyl 3-amino-3-naphthalen-1-ylpropanoate
CID 23109941
methyl (4S)-4-amino-4-naphthalen-1-ylbutanoate
CID 7145124
[(1R)-2-methoxy-1-naphthalen-1-yl-2-oxoethyl]azanium
CID 7315729
[2-amino-2-(3-aminoquinolin-4-yl)ethyl]carbamic acid
CID 57026745
2-amino-2-naphthalen-1-yl-N-propan-2-ylacetamide
CID 23548500
2-chloro-1-naphthalen-1-ylethanamine
CID 116937640
methyl (2S)-2-amino-2-naphthalen-1-ylacetate;hydrochloride
CID 171212058
[2,6-di(propan-2-yl)phenyl] N-(2-amino-2-phenylethyl)carbamate
CID 15675184
2,3-dihydroxybutanedioic acid;(1R)-1-naphthalen-1-ylethanamine
CID 158376535
ethyl N-(3-hydroxy-3-naphthalen-1-yl-2-phenylpropyl)carbamate
CID 131740477
3,3,3-trifluoro-1-naphthalen-1-ylpropan-1-amine
CID 62790893

Frequently Asked Questions

What is the IUPAC name of (2-amino-2-naphthalen-1-ylethyl)carbamic acid?
The IUPAC name of (2-amino-2-naphthalen-1-ylethyl)carbamic acid (CID 150721997) is (2-amino-2-naphthalen-1-ylethyl)carbamic acid.
What is the SMILES notation for (2-amino-2-naphthalen-1-ylethyl)carbamic acid?
The canonical SMILES for (2-amino-2-naphthalen-1-ylethyl)carbamic acid is NC(CNC(=O)O)c1cccc2ccccc12.
What is the InChIKey of (2-amino-2-naphthalen-1-ylethyl)carbamic acid?
The InChIKey is JQAYLMDYSRMEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c14-12(8-15-13(16)17)11-7-3-5-9-4-1-2-6-10(9)11/h1-7,12,15H,8,14H2,(H,16,17).
What are the key properties of (2-amino-2-naphthalen-1-ylethyl)carbamic acid?
(2-amino-2-naphthalen-1-ylethyl)carbamic acid has a molecular weight of 230.27 g/mol, XLogP of 2.11, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-2-naphthalen-1-ylethyl)carbamic acid is sourced from PubChem (CID 150721997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).