N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide

C19H25N3OS — CID 74233755

IUPACN-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide
SMILESCc1ccc(CN(C(=O)c2ccc(N(C)C)nc2)C2CCCC2)s1
InChIInChI=1S/C19H25N3OS/c1-14-8-10-17(24-14)13-22(16-6-4-5-7-16)19(23)15-9-11-18(20-12-15)21(2)3/h8-12,16H,4-7,13H2,1-3H3
InChIKeySIJPYMDEAPOXRA-UHFFFAOYSA-N
MW343.50 g/mol
LogP4.10
Rot. Bonds5

About N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide

N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide (PubChem CID 74233755) has the molecular formula C19H25N3OS and a molecular weight of 343.50 g/mol. Its IUPAC name is N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide
PubChem CID74233755
Molecular FormulaC19H25N3OS
Molecular Weight343.50 g/mol
Exact Mass343.17
IUPAC NameN-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide
SMILESCc1ccc(CN(C(=O)c2ccc(N(C)C)nc2)C2CCCC2)s1
InChIInChI=1S/C19H25N3OS/c1-14-8-10-17(24-14)13-22(16-6-4-5-7-16)19(23)15-9-11-18(20-12-15)21(2)3/h8-12,16H,4-7,13H2,1-3H3
InChIKeySIJPYMDEAPOXRA-UHFFFAOYSA-N
XLogP4.10
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.50
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide (CID 74233755) is N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide is Cc1ccc(CN(C(=O)c2ccc(N(C)C)nc2)C2CCCC2)s1.
What is the InChIKey of N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide?
The InChIKey is SIJPYMDEAPOXRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N3OS/c1-14-8-10-17(24-14)13-22(16-6-4-5-7-16)19(23)15-9-11-18(20-12-15)21(2)3/h8-12,16H,4-7,13H2,1-3H3.
What are the key properties of N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide?
N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide has a molecular weight of 343.50 g/mol, XLogP of 4.10, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-6-(dimethylamino)-N-[(5-methylthiophen-2-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 74233755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).