N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide

C15H29N3O2 — CID 77240288

IUPACN-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
SMILESCNCC(CC1CCCCC1)NC(=O)N1CCOCC1
InChIInChI=1S/C15H29N3O2/c1-16-12-14(11-13-5-3-2-4-6-13)17-15(19)18-7-9-20-10-8-18/h13-14,16H,2-12H2,1H3,(H,17,19)
InChIKeyIVAYFDMBMUCPRO-UHFFFAOYSA-N
MW283.42 g/mol
LogP1.59
Rot. Bonds5

About N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide

N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide (PubChem CID 77240288) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide.

Molecular Properties

Compound NameN-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
PubChem CID77240288
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC NameN-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
SMILESCNCC(CC1CCCCC1)NC(=O)N1CCOCC1
InChIInChI=1S/C15H29N3O2/c1-16-12-14(11-13-5-3-2-4-6-13)17-15(19)18-7-9-20-10-8-18/h13-14,16H,2-12H2,1H3,(H,17,19)
InChIKeyIVAYFDMBMUCPRO-UHFFFAOYSA-N
XLogP1.59
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
The IUPAC name of N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide (CID 77240288) is N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide.
What is the SMILES notation for N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
The canonical SMILES for N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide is CNCC(CC1CCCCC1)NC(=O)N1CCOCC1.
What is the InChIKey of N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
The InChIKey is IVAYFDMBMUCPRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-16-12-14(11-13-5-3-2-4-6-13)17-15(19)18-7-9-20-10-8-18/h13-14,16H,2-12H2,1H3,(H,17,19).
What are the key properties of N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide has a molecular weight of 283.42 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide is sourced from PubChem (CID 77240288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).