4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid

C14H24N2O2 — CID 69056934

IUPAC4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(C2CCN(C3CC3)CC2)CC1
InChIInChI=1S/C14H24N2O2/c17-14(18)16-9-5-12(6-10-16)11-3-7-15(8-4-11)13-1-2-13/h11-13H,1-10H2,(H,17,18)
InChIKeyMYVYPOROKPAPTF-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.25
Rot. Bonds2

About 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid

4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid (PubChem CID 69056934) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid.

Molecular Properties

Compound Name4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid
PubChem CID69056934
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid
SMILESO=C(O)N1CCC(C2CCN(C3CC3)CC2)CC1
InChIInChI=1S/C14H24N2O2/c17-14(18)16-9-5-12(6-10-16)11-3-7-15(8-4-11)13-1-2-13/h11-13H,1-10H2,(H,17,18)
InChIKeyMYVYPOROKPAPTF-UHFFFAOYSA-N
XLogP2.25
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(5-Azaspiro[2.5]octan-5-yl)-3-fluoropiperidine-1-carboxylic acid
CID 172761468
4-(1-Carboxypiperidin-4-yl)-3-fluoropiperidine-1-carboxylic acid
CID 178182220
4-[[Cyclohexyl(methyl)amino]methyl]piperidine-1-carboxylic acid
CID 22047732
4-Cyclopropylpiperidine-1-carboxylic acid
CID 56996090
9-Cyclopropyl-3,9-diazaspiro[5.5]undecane-3-carboxylic acid
CID 66661079
4-(1-Carboxypiperidin-4-yl)piperidine-1-carboxylic acid
CID 67217641
4-[1-(Cyclopropylmethyl)piperidin-4-yl]piperazine-1-carboxylic acid
CID 67449682
4-(2-Piperidin-1-ylethyl)piperidine-1-carboxylic acid
CID 68533612
4-(Piperidin-1-ylmethyl)piperidine-1-carboxylic acid
CID 68535576
4-(1-Butylpiperidin-4-yl)piperidine-1-carboxylic acid
CID 68593197
4-(1-Tert-butylpiperidin-4-yl)piperidine-1-carboxylic acid
CID 68668509
4-[[(3S)-1-cyclopropylpiperidin-3-yl]methyl]piperazine-1-carboxylic acid
CID 68705248

Frequently Asked Questions

What is the IUPAC name of 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid?
The IUPAC name of 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid (CID 69056934) is 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid.
What is the SMILES notation for 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid?
The canonical SMILES for 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid is O=C(O)N1CCC(C2CCN(C3CC3)CC2)CC1.
What is the InChIKey of 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid?
The InChIKey is MYVYPOROKPAPTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c17-14(18)16-9-5-12(6-10-16)11-3-7-15(8-4-11)13-1-2-13/h11-13H,1-10H2,(H,17,18).
What are the key properties of 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid?
4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid has a molecular weight of 252.36 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-cyclopropylpiperidin-4-yl)piperidine-1-carboxylic acid is sourced from PubChem (CID 69056934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).