N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide

C16H25N3O — CID 64731574

IUPACN-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)NC2CC(C)CC(C)C2)cn1
InChIInChI=1S/C16H25N3O/c1-4-17-15-6-5-13(10-18-15)16(20)19-14-8-11(2)7-12(3)9-14/h5-6,10-12,14H,4,7-9H2,1-3H3,(H,17,18)(H,19,20)
InChIKeyMBENILAMVDBZRX-UHFFFAOYSA-N
MW275.40 g/mol
LogP3.07
Rot. Bonds4

About N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide

N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide (PubChem CID 64731574) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide
PubChem CID64731574
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide
SMILESCCNc1ccc(C(=O)NC2CC(C)CC(C)C2)cn1
InChIInChI=1S/C16H25N3O/c1-4-17-15-6-5-13(10-18-15)16(20)19-14-8-11(2)7-12(3)9-14/h5-6,10-12,14H,4,7-9H2,1-3H3,(H,17,18)(H,19,20)
InChIKeyMBENILAMVDBZRX-UHFFFAOYSA-N
XLogP3.07
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide?
The IUPAC name of N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide (CID 64731574) is N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide is CCNc1ccc(C(=O)NC2CC(C)CC(C)C2)cn1.
What is the InChIKey of N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide?
The InChIKey is MBENILAMVDBZRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-4-17-15-6-5-13(10-18-15)16(20)19-14-8-11(2)7-12(3)9-14/h5-6,10-12,14H,4,7-9H2,1-3H3,(H,17,18)(H,19,20).
What are the key properties of N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide?
N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide has a molecular weight of 275.40 g/mol, XLogP of 3.07, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethylcyclohexyl)-6-(ethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 64731574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).