N-pentan-2-ylnaphthalene-2-carboxamide

C16H19NO — CID 15622075

IUPACN-pentan-2-ylnaphthalene-2-carboxamide
SMILESCCCC(C)NC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H19NO/c1-3-6-12(2)17-16(18)15-10-9-13-7-4-5-8-14(13)11-15/h4-5,7-12H,3,6H2,1-2H3,(H,17,18)
InChIKeyYCNSHALHCVWWDM-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.76
Rot. Bonds4

About N-pentan-2-ylnaphthalene-2-carboxamide

N-pentan-2-ylnaphthalene-2-carboxamide (PubChem CID 15622075) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is N-pentan-2-ylnaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-pentan-2-ylnaphthalene-2-carboxamide
PubChem CID15622075
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC NameN-pentan-2-ylnaphthalene-2-carboxamide
SMILESCCCC(C)NC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C16H19NO/c1-3-6-12(2)17-16(18)15-10-9-13-7-4-5-8-14(13)11-15/h4-5,7-12H,3,6H2,1-2H3,(H,17,18)
InChIKeyYCNSHALHCVWWDM-UHFFFAOYSA-N
XLogP3.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(1-bromopropan-2-yl)naphthalene-2-carboxamide
CID 114310701
N-[(2S)-1-(4-propan-2-ylphenoxy)propan-2-yl]naphthalene-2-carboxamide
CID 892675
3,4-dichloro-N-[(2S)-pentan-2-yl]benzamide
CID 879609
N-[(1R)-1-phenylethyl]naphthalene-2-carboxamide
CID 814202
N-propylnaphthalene-2-carboxamide
CID 6624536
methyl (2R,3S)-3-methyl-2-(naphthalene-2-carbonylamino)pentanoate
CID 9245605
(2R)-2-(methylamino)-1-naphthalen-2-ylpentan-1-one
CID 124518898
3-iodo-N-pentan-2-ylbenzamide
CID 2886291
3-methyl-1-naphthalen-2-ylhexan-1-one
CID 55187540
N-[(1R)-1-(4-ethylphenyl)-2-methylpropyl]naphthalene-2-carboxamide
CID 7671180
N-[(2R)-pentan-2-yl]-4-(2-phenylethynyl)benzamide
CID 32690633
3-hydroxy-2-(naphthalene-2-carbonylamino)butanoic acid
CID 16777702

Frequently Asked Questions

What is the IUPAC name of N-pentan-2-ylnaphthalene-2-carboxamide?
The IUPAC name of N-pentan-2-ylnaphthalene-2-carboxamide (CID 15622075) is N-pentan-2-ylnaphthalene-2-carboxamide.
What is the SMILES notation for N-pentan-2-ylnaphthalene-2-carboxamide?
The canonical SMILES for N-pentan-2-ylnaphthalene-2-carboxamide is CCCC(C)NC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-pentan-2-ylnaphthalene-2-carboxamide?
The InChIKey is YCNSHALHCVWWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-3-6-12(2)17-16(18)15-10-9-13-7-4-5-8-14(13)11-15/h4-5,7-12H,3,6H2,1-2H3,(H,17,18).
What are the key properties of N-pentan-2-ylnaphthalene-2-carboxamide?
N-pentan-2-ylnaphthalene-2-carboxamide has a molecular weight of 241.33 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-pentan-2-ylnaphthalene-2-carboxamide is sourced from PubChem (CID 15622075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).