N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide

C15H16N2O2 — CID 47161001

IUPACN-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide
SMILESCNC(=O)CCNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H16N2O2/c1-16-14(18)8-9-17-15(19)13-7-6-11-4-2-3-5-12(11)10-13/h2-7,10H,8-9H2,1H3,(H,16,18)(H,17,19)
InChIKeyDMAKNPQGPNCBRT-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.71
Rot. Bonds4

About N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide

N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide (PubChem CID 47161001) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide
PubChem CID47161001
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide
SMILESCNC(=O)CCNC(=O)c1ccc2ccccc2c1
InChIInChI=1S/C15H16N2O2/c1-16-14(18)8-9-17-15(19)13-7-6-11-4-2-3-5-12(11)10-13/h2-7,10H,8-9H2,1H3,(H,16,18)(H,17,19)
InChIKeyDMAKNPQGPNCBRT-UHFFFAOYSA-N
XLogP1.71
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[3-[4-(methylcarbamoylamino)anilino]-3-oxopropyl]naphthalene-2-carboxamide
CID 55596125
N-[3-(2-aminoethylamino)-3-oxopropyl]naphthalene-2-carboxamide
CID 119384874
N-propylnaphthalene-2-carboxamide
CID 6624536
N-[4-(naphthalene-2-carbonylamino)butyl]naphthalene-2-carboxamide
CID 101181857
N-(2-hydroxyethyl)naphthalene-2-carboxamide
CID 13288324
3-methyl-2-[3-(naphthalene-2-carbonylamino)propanoylamino]butanoic acid
CID 119169798
N-[3-(1-methoxypropan-2-ylamino)-3-oxopropyl]naphthalene-2-carboxamide
CID 46573507
N-[3-[(3-methyl-1,1-dioxothiolan-3-yl)amino]-3-oxopropyl]naphthalene-2-carboxamide
CID 55583174
N-[3-(methylamino)-3-oxopropyl]-1H-indole-5-carboxamide
CID 63718286
N-[3-[2-(2-fluorophenyl)ethylamino]-3-oxopropyl]naphthalene-2-carboxamide
CID 55568477
N-pentylnaphthalene-2-carboxamide
CID 91722098
N-[3-[(4-acetyl-1,3-thiazol-2-yl)amino]-3-oxopropyl]naphthalene-2-carboxamide
CID 55583002

Frequently Asked Questions

What is the IUPAC name of N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide?
The IUPAC name of N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide (CID 47161001) is N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide is CNC(=O)CCNC(=O)c1ccc2ccccc2c1.
What is the InChIKey of N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide?
The InChIKey is DMAKNPQGPNCBRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-16-14(18)8-9-17-15(19)13-7-6-11-4-2-3-5-12(11)10-13/h2-7,10H,8-9H2,1H3,(H,16,18)(H,17,19).
What are the key properties of N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide?
N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(methylamino)-3-oxopropyl]naphthalene-2-carboxamide is sourced from PubChem (CID 47161001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).