N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine

C19H30N4O — CID 118263769

IUPACN-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine
SMILES[H]/N=C/c1cc(C)cnc1N1CCC(NC2CCCCC2)C(OC)C1
InChIInChI=1S/C19H30N4O/c1-14-10-15(11-20)19(21-12-14)23-9-8-17(18(13-23)24-2)22-16-6-4-3-5-7-16/h10-12,16-18,20,22H,3-9,13H2,1-2H3/b20-11+
InChIKeySVXNQCSEWWFWGP-RGVLZGJSSA-N
MW330.48 g/mol
LogP2.90
Rot. Bonds5

About N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine

N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine (PubChem CID 118263769) has the molecular formula C19H30N4O and a molecular weight of 330.48 g/mol. Its IUPAC name is N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine.

Molecular Properties

Compound NameN-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine
PubChem CID118263769
Molecular FormulaC19H30N4O
Molecular Weight330.48 g/mol
Exact Mass330.24
IUPAC NameN-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine
SMILES[H]/N=C/c1cc(C)cnc1N1CCC(NC2CCCCC2)C(OC)C1
InChIInChI=1S/C19H30N4O/c1-14-10-15(11-20)19(21-12-14)23-9-8-17(18(13-23)24-2)22-16-6-4-3-5-7-16/h10-12,16-18,20,22H,3-9,13H2,1-2H3/b20-11+
InChIKeySVXNQCSEWWFWGP-RGVLZGJSSA-N
XLogP2.90
TPSA61.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.48
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine?
The IUPAC name of N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine (CID 118263769) is N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine.
What is the SMILES notation for N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine?
The canonical SMILES for N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine is [H]/N=C/c1cc(C)cnc1N1CCC(NC2CCCCC2)C(OC)C1.
What is the InChIKey of N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine?
The InChIKey is SVXNQCSEWWFWGP-RGVLZGJSSA-N. The full InChI is InChI=1S/C19H30N4O/c1-14-10-15(11-20)19(21-12-14)23-9-8-17(18(13-23)24-2)22-16-6-4-3-5-7-16/h10-12,16-18,20,22H,3-9,13H2,1-2H3/b20-11+.
What are the key properties of N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine?
N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine has a molecular weight of 330.48 g/mol, XLogP of 2.90, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-1-(3-methanimidoyl-5-methyl-2-pyridinyl)-3-methoxypiperidin-4-amine is sourced from PubChem (CID 118263769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).