2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid

C10H19NO2 — CID 67554583

IUPAC2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid
SMILESCNC(CC1(C)CCCC1)C(=O)O
InChIInChI=1S/C10H19NO2/c1-10(5-3-4-6-10)7-8(11-2)9(12)13/h8,11H,3-7H2,1-2H3,(H,12,13)
InChIKeyZKVRTLQADLURDP-UHFFFAOYSA-N
MW185.27 g/mol
LogP1.63
Rot. Bonds4

About 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid

2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid (PubChem CID 67554583) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid.

Molecular Properties

Compound Name2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid
PubChem CID67554583
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid
SMILESCNC(CC1(C)CCCC1)C(=O)O
InChIInChI=1S/C10H19NO2/c1-10(5-3-4-6-10)7-8(11-2)9(12)13/h8,11H,3-7H2,1-2H3,(H,12,13)
InChIKeyZKVRTLQADLURDP-UHFFFAOYSA-N
XLogP1.63
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;2-(methylamino)-1-(1-methylcyclohexyl)pentan-3-one
CID 142227947
2-(2,2-dimethylpropanoylamino)-3-(1-methylcyclopentyl)propanoic acid
CID 174649408
lithium;2-(diethylcarbamoylamino)-3-(1-methylcyclopentyl)propanoic acid;hydride
CID 173484127
lithium;hydride;3-(1-methylcyclopentyl)-2-(pyrrolidine-1-carbonylamino)propanoic acid
CID 173484144
[1-(methylamino)-3-(1-methylcyclohexyl)propan-2-yl]carbamic acid
CID 123916834
2-methyl-3-[(1-methylcyclopentyl)methylamino]propanoic acid
CID 63821690
2-(methylamino)-2-(1-methylcyclopentyl)acetic acid
CID 130965432
methyl (2S)-2-amino-3-(1-methylcyclopentyl)propanoate
CID 58564877
(2S)-4-methyl-2-[(1-methylcyclopentyl)methylcarbamoylamino]pentanoic acid
CID 63830703
2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-(1-methylcyclohexyl)propanoic acid
CID 165485041
2-[(1-methylcyclopentyl)amino]pentanoic acid
CID 83041723
2-(1-methylcyclohexyl)ethane-1,1-diol
CID 59872782

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid?
The IUPAC name of 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid (CID 67554583) is 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid.
What is the SMILES notation for 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid?
The canonical SMILES for 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid is CNC(CC1(C)CCCC1)C(=O)O.
What is the InChIKey of 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid?
The InChIKey is ZKVRTLQADLURDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-10(5-3-4-6-10)7-8(11-2)9(12)13/h8,11H,3-7H2,1-2H3,(H,12,13).
What are the key properties of 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid?
2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid has a molecular weight of 185.27 g/mol, XLogP of 1.63, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-3-(1-methylcyclopentyl)propanoic acid is sourced from PubChem (CID 67554583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).