1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid

C12H21NO2 — CID 65054107

IUPAC1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid
SMILESCCC(C1CC1)N1CCCCC1C(=O)O
InChIInChI=1S/C12H21NO2/c1-2-10(9-6-7-9)13-8-4-3-5-11(13)12(14)15/h9-11H,2-8H2,1H3,(H,14,15)
InChIKeyKVEDNXYEPLXWFY-UHFFFAOYSA-N
MW211.30 g/mol
LogP2.11
Rot. Bonds4

About 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid

1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid (PubChem CID 65054107) has the molecular formula C12H21NO2 and a molecular weight of 211.30 g/mol. Its IUPAC name is 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid
PubChem CID65054107
Molecular FormulaC12H21NO2
Molecular Weight211.30 g/mol
Exact Mass211.16
IUPAC Name1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid
SMILESCCC(C1CC1)N1CCCCC1C(=O)O
InChIInChI=1S/C12H21NO2/c1-2-10(9-6-7-9)13-8-4-3-5-11(13)12(14)15/h9-11H,2-8H2,1H3,(H,14,15)
InChIKeyKVEDNXYEPLXWFY-UHFFFAOYSA-N
XLogP2.11
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.30
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-propan-2-ylpiperidine-2-carboxylic acid
CID 144742898
1-[1-(butan-2-ylamino)-1-oxopropan-2-yl]piperidine-2-carboxylic acid
CID 43440972
1-[1-(4-hydroxyphenyl)propyl]piperidine-2-carboxylic acid
CID 65053879
1-(1-amino-1-oxopropan-2-yl)azepane-2-carboxylic acid
CID 64564332
1-(1-methoxybutan-2-yl)pyrrolidine-2-carboxylic acid
CID 65056161
1-[1-(4-fluorophenyl)propyl]azepane-2-carboxylic acid
CID 65069857
1-(1-methoxy-1-oxopropan-2-yl)piperidine-2-carboxylic acid
CID 82223955
1-(dihydroxymethyl)pyrrolidine-2-carboxylic acid
CID 22996998
1-(1-carboxyethyl)pyrrolidine-2-carboxylic acid
CID 110185971
(2S)-1-[(1R)-1-hydroxypropyl]azetidine-2-carboxylic acid
CID 162895327
1-[1-(2-fluorophenyl)propyl]azepane-2-carboxylic acid
CID 115997267
1-[1-(5-methyl-2-pyridinyl)propyl]piperidine-2-carboxylic acid
CID 5233551

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid?
The IUPAC name of 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid (CID 65054107) is 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid.
What is the SMILES notation for 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid?
The canonical SMILES for 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid is CCC(C1CC1)N1CCCCC1C(=O)O.
What is the InChIKey of 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid?
The InChIKey is KVEDNXYEPLXWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO2/c1-2-10(9-6-7-9)13-8-4-3-5-11(13)12(14)15/h9-11H,2-8H2,1H3,(H,14,15).
What are the key properties of 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid?
1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid has a molecular weight of 211.30 g/mol, XLogP of 2.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropylpropyl)piperidine-2-carboxylic acid is sourced from PubChem (CID 65054107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).