N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide

C22H21N3O — CID 68874752

IUPACN-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide
SMILESO=C(NCN1CC=C(c2ccccn2)CC1)c1cccc2ccccc12
InChIInChI=1S/C22H21N3O/c26-22(20-9-5-7-17-6-1-2-8-19(17)20)24-16-25-14-11-18(12-15-25)21-10-3-4-13-23-21/h1-11,13H,12,14-16H2,(H,24,26)
InChIKeySNRHNWOBNMAOIY-UHFFFAOYSA-N
MW343.43 g/mol
LogP3.71
Rot. Bonds4

About N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide

N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide (PubChem CID 68874752) has the molecular formula C22H21N3O and a molecular weight of 343.43 g/mol. Its IUPAC name is N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide.

Molecular Properties

Compound NameN-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide
PubChem CID68874752
Molecular FormulaC22H21N3O
Molecular Weight343.43 g/mol
Exact Mass343.17
IUPAC NameN-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide
SMILESO=C(NCN1CC=C(c2ccccn2)CC1)c1cccc2ccccc12
InChIInChI=1S/C22H21N3O/c26-22(20-9-5-7-17-6-1-2-8-19(17)20)24-16-25-14-11-18(12-15-25)21-10-3-4-13-23-21/h1-11,13H,12,14-16H2,(H,24,26)
InChIKeySNRHNWOBNMAOIY-UHFFFAOYSA-N
XLogP3.71
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.43
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[[4-(3-methyl-2-pyridinyl)-3,6-dihydro-2H-pyridin-1-yl]methyl]benzamide
CID 68876204
5-(naphthalene-1-carbonylamino)-3-pyridin-2-yl-1,2-oxazole-4-carboxylic acid
CID 142773824
N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]naphthalene-1-carboxamide
CID 31413484
N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]naphthalene-1-carboxamide
CID 31644651
4-fluoro-N-[2-(4-naphthalen-1-yl-3,6-dihydro-2H-pyridin-1-yl)ethyl]benzamide
CID 19096211
N-[(1-methylimidazol-2-yl)methyl]naphthalene-1-carboxamide
CID 110440177
N-[11-(naphthalene-1-carbonylamino)undecyl]naphthalene-1-carboxamide
CID 137492009
N-(3-chloropropyl)naphthalene-1-carboxamide
CID 17164120
N-[2-(4-pyridin-2-ylpiperazin-1-yl)pyrimidin-5-yl]naphthalene-1-carboxamide
CID 71790052
N-[(2-morpholin-4-ylpyrimidin-4-yl)methyl]naphthalene-1-carboxamide
CID 91967362
N-ethyl-2-pyridin-2-ylquinoline-4-carboxamide
CID 17473754
N-(1,2,3,6-tetrahydropyridin-4-ylmethyl)naphthalene-1-carboxamide
CID 114693786

Frequently Asked Questions

What is the IUPAC name of N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide?
The IUPAC name of N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide (CID 68874752) is N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide.
What is the SMILES notation for N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide?
The canonical SMILES for N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide is O=C(NCN1CC=C(c2ccccn2)CC1)c1cccc2ccccc12.
What is the InChIKey of N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide?
The InChIKey is SNRHNWOBNMAOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O/c26-22(20-9-5-7-17-6-1-2-8-19(17)20)24-16-25-14-11-18(12-15-25)21-10-3-4-13-23-21/h1-11,13H,12,14-16H2,(H,24,26).
What are the key properties of N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide?
N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide has a molecular weight of 343.43 g/mol, XLogP of 3.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-pyridin-2-yl-3,6-dihydro-2H-pyridin-1-yl)methyl]naphthalene-1-carboxamide is sourced from PubChem (CID 68874752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).