1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine

C19H32N4O — CID 91835973

IUPAC1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine
SMILESCN(Cc1nccn1C1CC1)CC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C19H32N4O/c1-21(15-18-20-9-10-23(18)17-5-6-17)16-19(7-3-2-4-8-19)22-11-13-24-14-12-22/h9-10,17H,2-8,11-16H2,1H3
InChIKeyZIDAACOTNBIYGB-UHFFFAOYSA-N
MW332.49 g/mol
LogP2.68
Rot. Bonds6

About 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine

1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine (PubChem CID 91835973) has the molecular formula C19H32N4O and a molecular weight of 332.49 g/mol. Its IUPAC name is 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine.

Molecular Properties

Compound Name1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine
PubChem CID91835973
Molecular FormulaC19H32N4O
Molecular Weight332.49 g/mol
Exact Mass332.26
IUPAC Name1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine
SMILESCN(Cc1nccn1C1CC1)CC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C19H32N4O/c1-21(15-18-20-9-10-23(18)17-5-6-17)16-19(7-3-2-4-8-19)22-11-13-24-14-12-22/h9-10,17H,2-8,11-16H2,1H3
InChIKeyZIDAACOTNBIYGB-UHFFFAOYSA-N
XLogP2.68
TPSA33.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.49
LogP ≤ 52.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine?
The IUPAC name of 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine (CID 91835973) is 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine.
What is the SMILES notation for 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine?
The canonical SMILES for 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine is CN(Cc1nccn1C1CC1)CC1(N2CCOCC2)CCCCC1.
What is the InChIKey of 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine?
The InChIKey is ZIDAACOTNBIYGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N4O/c1-21(15-18-20-9-10-23(18)17-5-6-17)16-19(7-3-2-4-8-19)22-11-13-24-14-12-22/h9-10,17H,2-8,11-16H2,1H3.
What are the key properties of 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine?
1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine has a molecular weight of 332.49 g/mol, XLogP of 2.68, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylimidazol-2-yl)-N-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]methanamine is sourced from PubChem (CID 91835973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).