2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide

C15H29N3O2 — CID 106592975

IUPAC2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
SMILESCC(C(=O)NCC1CN(C)CCO1)C1CCCC(N)C1
InChIInChI=1S/C15H29N3O2/c1-11(12-4-3-5-13(16)8-12)15(19)17-9-14-10-18(2)6-7-20-14/h11-14H,3-10,16H2,1-2H3,(H,17,19)
InChIKeyIDFGIXFSHWSUJH-UHFFFAOYSA-N
MW283.42 g/mol
LogP0.59
Rot. Bonds4

About 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide

2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide (PubChem CID 106592975) has the molecular formula C15H29N3O2 and a molecular weight of 283.42 g/mol. Its IUPAC name is 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide.

Molecular Properties

Compound Name2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
PubChem CID106592975
Molecular FormulaC15H29N3O2
Molecular Weight283.42 g/mol
Exact Mass283.23
IUPAC Name2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide
SMILESCC(C(=O)NCC1CN(C)CCO1)C1CCCC(N)C1
InChIInChI=1S/C15H29N3O2/c1-11(12-4-3-5-13(16)8-12)15(19)17-9-14-10-18(2)6-7-20-14/h11-14H,3-10,16H2,1-2H3,(H,17,19)
InChIKeyIDFGIXFSHWSUJH-UHFFFAOYSA-N
XLogP0.59
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.42
LogP ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-aminocyclohexyl)-N-(oxolan-2-ylmethyl)propanamide
CID 106592649
2-(3-aminocyclohexyl)-N-[(1-methylpyrrolidin-3-yl)methyl]propanamide
CID 106592732
2-methyl-N-[[(2S)-4-methylmorpholin-2-yl]methyl]propanamide
CID 153398973
2,3-dimethyl-4-[(4-methylmorpholin-2-yl)methylamino]-4-oxobutanoic acid
CID 103498729
2-(3-aminocyclohexyl)-N-[(1-methylpiperidin-2-yl)methyl]propanamide
CID 106592824
1-N-[(4-methylmorpholin-2-yl)methyl]cyclohexane-1,3-diamine
CID 79458603
2-amino-3-methyl-N-[(4-methylmorpholin-2-yl)methyl]cyclohexane-1-carboxamide
CID 79071178
2-bromo-N-[(4-methylmorpholin-2-yl)methyl]butanamide
CID 79082924
4-amino-N-[(4-methylmorpholin-2-yl)methyl]cyclohexane-1-carboxamide
CID 79081947
N-[[(2S)-4-methylmorpholin-2-yl]methyl]acetamide
CID 170608678
N-[(4-methylmorpholin-2-yl)methyl]acetamide
CID 69087754
N-methyl-2-[(4-methylmorpholin-2-yl)methylamino]propanamide
CID 78945377

Frequently Asked Questions

What is the IUPAC name of 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
The IUPAC name of 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide (CID 106592975) is 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide.
What is the SMILES notation for 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
The canonical SMILES for 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide is CC(C(=O)NCC1CN(C)CCO1)C1CCCC(N)C1.
What is the InChIKey of 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
The InChIKey is IDFGIXFSHWSUJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O2/c1-11(12-4-3-5-13(16)8-12)15(19)17-9-14-10-18(2)6-7-20-14/h11-14H,3-10,16H2,1-2H3,(H,17,19).
What are the key properties of 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide?
2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide has a molecular weight of 283.42 g/mol, XLogP of 0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-aminocyclohexyl)-N-[(4-methylmorpholin-2-yl)methyl]propanamide is sourced from PubChem (CID 106592975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).