2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide

C12H24N2O2 — CID 81083505

IUPAC2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide
SMILESCOCC(N)C(=O)N(C)C1CCCCCC1
InChIInChI=1S/C12H24N2O2/c1-14(12(15)11(13)9-16-2)10-7-5-3-4-6-8-10/h10-11H,3-9,13H2,1-2H3
InChIKeyGKPIDANNWYUTKV-UHFFFAOYSA-N
MW228.34 g/mol
LogP1.14
Rot. Bonds4

About 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide

2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide (PubChem CID 81083505) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide.

Molecular Properties

Compound Name2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide
PubChem CID81083505
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC Name2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide
SMILESCOCC(N)C(=O)N(C)C1CCCCCC1
InChIInChI=1S/C12H24N2O2/c1-14(12(15)11(13)9-16-2)10-7-5-3-4-6-8-10/h10-11H,3-9,13H2,1-2H3
InChIKeyGKPIDANNWYUTKV-UHFFFAOYSA-N
XLogP1.14
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-3-methoxy-N-methyl-N-(3-methylcyclohexyl)propanamide
CID 81088861
2-amino-3-methoxy-N-methyl-N-(1-methylpiperidin-4-yl)propanamide
CID 81082211
(2S)-2-amino-N-cycloheptyl-N-methylbutanamide;hydrochloride
CID 119275217
2-amino-N-cyclopentyl-5-methoxy-N-methylpentanamide
CID 81081449
2-amino-N-cyclohexyl-N-ethyl-3-methoxypropanamide
CID 81080942
(2S)-2-amino-N-cyclobutyl-3-hydroxy-N-methylpropanamide
CID 70338344
2-amino-N-cyclopentyl-3-methoxy-N-(3-methylbutyl)propanamide
CID 81101488
2-amino-N-cyclooctyl-N-methylpropanamide
CID 83630474
3-amino-4-[cyclopentyl(methyl)amino]-4-oxobutanoic acid
CID 64894882
4-amino-5-[cyclohexyl(methyl)amino]-5-oxopentanoic acid
CID 64894822
(2R)-2-amino-N-cyclobutyl-N-methylpentanamide
CID 103797073
(2S)-2-amino-N-cyclopentyl-N-methylhexanamide
CID 103831134

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide?
The IUPAC name of 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide (CID 81083505) is 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide.
What is the SMILES notation for 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide?
The canonical SMILES for 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide is COCC(N)C(=O)N(C)C1CCCCCC1.
What is the InChIKey of 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide?
The InChIKey is GKPIDANNWYUTKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c1-14(12(15)11(13)9-16-2)10-7-5-3-4-6-8-10/h10-11H,3-9,13H2,1-2H3.
What are the key properties of 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide?
2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide has a molecular weight of 228.34 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cycloheptyl-3-methoxy-N-methylpropanamide is sourced from PubChem (CID 81083505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).