1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride

C14H21ClN2O2 — CID 119714874

IUPAC1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride
SMILESCC(C)COc1cccc(NC(=O)C2(N)CC2)c1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-10(2)9-18-12-5-3-4-11(8-12)16-13(17)14(15)6-7-14;/h3-5,8,10H,6-7,9,15H2,1-2H3,(H,16,17);1H
InChIKeyJQMFVFWRCYMOAW-UHFFFAOYSA-N
MW284.79 g/mol
LogP2.57
Rot. Bonds5

About 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride

1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride (PubChem CID 119714874) has the molecular formula C14H21ClN2O2 and a molecular weight of 284.79 g/mol. Its IUPAC name is 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride.

Molecular Properties

Compound Name1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride
PubChem CID119714874
Molecular FormulaC14H21ClN2O2
Molecular Weight284.79 g/mol
Exact Mass284.13
IUPAC Name1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride
SMILESCC(C)COc1cccc(NC(=O)C2(N)CC2)c1.Cl
InChIInChI=1S/C14H20N2O2.ClH/c1-10(2)9-18-12-5-3-4-11(8-12)16-13(17)14(15)6-7-14;/h3-5,8,10H,6-7,9,15H2,1-2H3,(H,16,17);1H
InChIKeyJQMFVFWRCYMOAW-UHFFFAOYSA-N
XLogP2.57
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.79
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-N-[3-(2-amino-2-oxoethoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride
CID 119702073
1-(aminomethyl)-N-[3-(2-methylpropoxy)phenyl]cyclobutane-1-carboxamide
CID 115447865
N-[3-(2-methylpropoxy)phenyl]acetamide
CID 23343374
1,3-bis[3-(2-methylpropoxy)phenyl]urea
CID 17170442
1-amino-N-[3-[2-(dimethylamino)ethoxy]phenyl]cyclopropane-1-carboxamide
CID 65464434
3-methyl-N-[3-(2-methylpropoxy)phenyl]pyrrolidine-3-carboxamide
CID 63139773
2-amino-3-methyl-N-[3-(2-methylpropoxy)phenyl]butanamide;hydrochloride
CID 119284740
ethyl 3-[3-(2-methylpropoxy)anilino]-3-oxopropanoate
CID 17097553
(2S)-2-amino-3-methyl-N-[3-(2-methylpropoxy)phenyl]butanamide;hydrochloride
CID 119284742
ethyl N-[3-(2-methylpropoxy)phenyl]carbamate
CID 60643144
1-amino-N-(3-methoxyphenyl)cyclopentane-1-carboxamide;hydrochloride
CID 119261882
1-amino-N-[3-(2-amino-2-oxoethoxy)phenyl]cyclopentane-1-carboxamide
CID 60852261

Frequently Asked Questions

What is the IUPAC name of 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride?
The IUPAC name of 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride (CID 119714874) is 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride.
What is the SMILES notation for 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride?
The canonical SMILES for 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride is CC(C)COc1cccc(NC(=O)C2(N)CC2)c1.Cl.
What is the InChIKey of 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride?
The InChIKey is JQMFVFWRCYMOAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2.ClH/c1-10(2)9-18-12-5-3-4-11(8-12)16-13(17)14(15)6-7-14;/h3-5,8,10H,6-7,9,15H2,1-2H3,(H,16,17);1H.
What are the key properties of 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride?
1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride has a molecular weight of 284.79 g/mol, XLogP of 2.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-N-[3-(2-methylpropoxy)phenyl]cyclopropane-1-carboxamide;hydrochloride is sourced from PubChem (CID 119714874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).