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

C15H29N3O2 — CID 69467514

IUPAC2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
SMILESCNC[C@H](CC1CCCCC1)C1CN(C(N)=O)CCO1
InChIInChI=1S/C15H29N3O2/c1-17-10-13(9-12-5-3-2-4-6-12)14-11-18(15(16)19)7-8-20-14/h12-14,17H,2-11H2,1H3,(H2,16,19)/t13-,14?/m0/s1
InChIKeyHXBACOWWPQYCEI-LSLKUGRBSA-N
MW283.42 g/mol
LogP1.57
Rot. Bonds5

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

2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide (PubChem CID 69467514) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide.

Molecular Properties

Compound Name2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
PubChem CID69467514
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide
SMILESCNC[C@H](CC1CCCCC1)C1CN(C(N)=O)CCO1
InChIInChI=1S/C15H29N3O2/c1-17-10-13(9-12-5-3-2-4-6-12)14-11-18(15(16)19)7-8-20-14/h12-14,17H,2-11H2,1H3,(H2,16,19)/t13-,14?/m0/s1
InChIKeyHXBACOWWPQYCEI-LSLKUGRBSA-N
XLogP1.57
TPSA67.59 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 ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
The IUPAC name of 2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide (CID 69467514) is 2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide.
What is the SMILES notation for 2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
The canonical SMILES for 2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide is CNC[C@H](CC1CCCCC1)C1CN(C(N)=O)CCO1.
What is the InChIKey of 2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
The InChIKey is HXBACOWWPQYCEI-LSLKUGRBSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-17-10-13(9-12-5-3-2-4-6-12)14-11-18(15(16)19)7-8-20-14/h12-14,17H,2-11H2,1H3,(H2,16,19)/t13-,14?/m0/s1.
What are the key properties of 2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide?
2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide has a molecular weight of 283.42 g/mol, XLogP of 1.57, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-4-carboxamide is sourced from PubChem (CID 69467514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).