N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide

C18H21NO2 — CID 60654196

IUPACN-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C18H21NO2/c1-2-9-19(12-13-7-8-13)18(21)16-10-14-5-3-4-6-15(14)11-17(16)20/h3-6,10-11,13,20H,2,7-9,12H2,1H3
InChIKeyMSVYDWZJNMBZEB-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.81
Rot. Bonds5

About N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide

N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide (PubChem CID 60654196) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide
PubChem CID60654196
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1cc2ccccc2cc1O
InChIInChI=1S/C18H21NO2/c1-2-9-19(12-13-7-8-13)18(21)16-10-14-5-3-4-6-15(14)11-17(16)20/h3-6,10-11,13,20H,2,7-9,12H2,1H3
InChIKeyMSVYDWZJNMBZEB-UHFFFAOYSA-N
XLogP3.81
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-hydroxy-N-methyl-N-propylnaphthalene-2-carboxamide
CID 43624990
2-amino-N-(cyclopropylmethyl)-N-propylbenzamide
CID 22493330
2-bromo-N-(cyclopropylmethyl)-N-propylbenzamide
CID 60637824
N-(cyclopropylmethyl)-N-propyl-1-benzothiophene-2-carboxamide
CID 134029193
N-(cyclopropylmethyl)-2-fluoro-6-hydroxy-N-propylbenzamide
CID 104916648
1-(cyclopropylmethyl)-3-naphthalen-2-yl-1-propylurea
CID 3853598
3-chloro-N-(cyclopropylmethyl)-4-hydroxy-N-propylbenzamide
CID 60654225
N-(cyclopropylmethyl)-N-propyl-1-benzofuran-3-carboxamide
CID 77086659
5-chloro-2-hydroxy-N-(piperidin-4-ylmethyl)-N-propylbenzamide
CID 79702379
N-(cyclopropylmethyl)-N-propyl-3-sulfanylbenzamide
CID 107024680
N-(cyclopropylmethyl)-2-methyl-N-propyl-5-sulfamoylbenzamide
CID 60637766
N-(cyclopropylmethyl)-N-propyl-1H-indole-6-carboxamide
CID 61060523

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide (CID 60654196) is N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide is CCCN(CC1CC1)C(=O)c1cc2ccccc2cc1O.
What is the InChIKey of N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide?
The InChIKey is MSVYDWZJNMBZEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-2-9-19(12-13-7-8-13)18(21)16-10-14-5-3-4-6-15(14)11-17(16)20/h3-6,10-11,13,20H,2,7-9,12H2,1H3.
What are the key properties of N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide?
N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide has a molecular weight of 283.37 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-3-hydroxy-N-propylnaphthalene-2-carboxamide is sourced from PubChem (CID 60654196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).