3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide

C15H23N3O — CID 105070514

IUPAC3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide
SMILESCNc1cnccc1C(=O)NC1CCCCCC1C
InChIInChI=1S/C15H23N3O/c1-11-6-4-3-5-7-13(11)18-15(19)12-8-9-17-10-14(12)16-2/h8-11,13,16H,3-7H2,1-2H3,(H,18,19)
InChIKeyVVVLDKAKFXDJHD-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.82
Rot. Bonds3

About 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide

3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide (PubChem CID 105070514) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide
PubChem CID105070514
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide
SMILESCNc1cnccc1C(=O)NC1CCCCCC1C
InChIInChI=1S/C15H23N3O/c1-11-6-4-3-5-7-13(11)18-15(19)12-8-9-17-10-14(12)16-2/h8-11,13,16H,3-7H2,1-2H3,(H,18,19)
InChIKeyVVVLDKAKFXDJHD-UHFFFAOYSA-N
XLogP2.82
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-(methylamino)-N-(2-propan-2-ylcyclohexyl)pyridine-4-carboxamide
CID 105070917
N-cyclopropyl-3-(methylamino)pyridine-4-carboxamide
CID 105068162
4-(methylamino)-N-(2-methylcyclopropyl)pyridine-3-carboxamide
CID 81240460
3-(ethylamino)-N-(2-hydroxycycloheptyl)pyridine-4-carboxamide
CID 105071069
N-(2-methylcyclohexyl)pyridine-4-carboxamide
CID 24819408
3-(methylamino)-N-(oxan-4-yl)pyridine-4-carboxamide
CID 105068747
N-(2-methylcyclohexyl)pyridine-3-carboxamide
CID 11841361
N-(4-ethylcyclohexyl)-3-(methylamino)pyridine-4-carboxamide
CID 105069028
3-(methylamino)-N-(thiolan-3-yl)pyridine-4-carboxamide
CID 103064751
N-(2,4-dimethylcyclohexyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105070253
N-(dicyclopropylmethyl)-3-(methylamino)pyridine-4-carboxamide
CID 105069656
3-hydroxy-2-methyl-N-(2-methylcycloheptyl)benzamide
CID 82829354

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide?
The IUPAC name of 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide (CID 105070514) is 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide?
The canonical SMILES for 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide is CNc1cnccc1C(=O)NC1CCCCCC1C.
What is the InChIKey of 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide?
The InChIKey is VVVLDKAKFXDJHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11-6-4-3-5-7-13(11)18-15(19)12-8-9-17-10-14(12)16-2/h8-11,13,16H,3-7H2,1-2H3,(H,18,19).
What are the key properties of 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide?
3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide has a molecular weight of 261.37 g/mol, XLogP of 2.82, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-N-(2-methylcycloheptyl)pyridine-4-carboxamide is sourced from PubChem (CID 105070514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).