2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide

C14H27N3O2 — CID 62548940

IUPAC2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide
SMILESNCC1CN(CC(=O)NC2CCCCCC2)CCO1
InChIInChI=1S/C14H27N3O2/c15-9-13-10-17(7-8-19-13)11-14(18)16-12-5-3-1-2-4-6-12/h12-13H,1-11,15H2,(H,16,18)
InChIKeyFZAORPBMQQXLOH-UHFFFAOYSA-N
MW269.39 g/mol
LogP0.48
Rot. Bonds4

About 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide

2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide (PubChem CID 62548940) has the molecular formula C14H27N3O2 and a molecular weight of 269.39 g/mol. Its IUPAC name is 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide.

Molecular Properties

Compound Name2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide
PubChem CID62548940
Molecular FormulaC14H27N3O2
Molecular Weight269.39 g/mol
Exact Mass269.21
IUPAC Name2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide
SMILESNCC1CN(CC(=O)NC2CCCCCC2)CCO1
InChIInChI=1S/C14H27N3O2/c15-9-13-10-17(7-8-19-13)11-14(18)16-12-5-3-1-2-4-6-12/h12-13H,1-11,15H2,(H,16,18)
InChIKeyFZAORPBMQQXLOH-UHFFFAOYSA-N
XLogP0.48
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(aminomethyl)morpholin-4-yl]-N-(cyclopropylcarbamoyl)acetamide
CID 114394847
2-[2-(aminomethyl)morpholin-4-yl]-N-methylacetamide
CID 61336632
2-(2-carbamothioylmorpholin-4-yl)-N-cyclopentylacetamide
CID 79681734
methyl 4-[2-(cyclopentylamino)-2-oxoethyl]morpholine-2-carboxylate
CID 78926342
2-[2-(aminomethyl)morpholin-4-yl]-N-propylacetamide
CID 61336633
2-[2-(aminomethyl)-1,4-oxazepan-4-yl]-N-methylacetamide
CID 131054195
2-[3-(aminomethyl)piperidin-1-yl]-N-cyclopentylacetamide;hydrochloride
CID 119915633
2-[2-(aminomethyl)morpholin-4-yl]-N-butylacetamide
CID 61485522
2-(3-aminoazetidin-1-yl)-N-cycloheptylacetamide
CID 63760720
2-[2-(aminomethyl)morpholin-4-yl]-N-phenylacetamide
CID 61336829
N-cyclohexyl-2-[(3S)-3-hydroxypiperidin-1-yl]acetamide
CID 107225773
N-cyclopentyl-2-[(3R)-3-hydroxypyrrolidin-1-yl]acetamide
CID 78962574

Frequently Asked Questions

What is the IUPAC name of 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide?
The IUPAC name of 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide (CID 62548940) is 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide.
What is the SMILES notation for 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide?
The canonical SMILES for 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide is NCC1CN(CC(=O)NC2CCCCCC2)CCO1.
What is the InChIKey of 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide?
The InChIKey is FZAORPBMQQXLOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3O2/c15-9-13-10-17(7-8-19-13)11-14(18)16-12-5-3-1-2-4-6-12/h12-13H,1-11,15H2,(H,16,18).
What are the key properties of 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide?
2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide has a molecular weight of 269.39 g/mol, XLogP of 0.48, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(aminomethyl)morpholin-4-yl]-N-cycloheptylacetamide is sourced from PubChem (CID 62548940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).