2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate

C13H24N2O2 — CID 69398316

IUPAC2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate
SMILESCC(C)COC(=O)N1CCC(NC2CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-10(2)9-17-13(16)15-7-5-12(6-8-15)14-11-3-4-11/h10-12,14H,3-9H2,1-2H3
InChIKeyCOZCSVSEBVWFTO-UHFFFAOYSA-N
MW240.35 g/mol
LogP2.00
Rot. Bonds4

About 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate

2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate (PubChem CID 69398316) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate.

Molecular Properties

Compound Name2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate
PubChem CID69398316
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate
SMILESCC(C)COC(=O)N1CCC(NC2CC2)CC1
InChIInChI=1S/C13H24N2O2/c1-10(2)9-17-13(16)15-7-5-12(6-8-15)14-11-3-4-11/h10-12,14H,3-9H2,1-2H3
InChIKeyCOZCSVSEBVWFTO-UHFFFAOYSA-N
XLogP2.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methylpropyl 4-(propan-2-ylamino)piperidine-1-carboxylate
CID 142781179
2-methylpropyl 4-[[(1R,2S)-2-hydroxycyclohexyl]amino]piperidine-1-carboxylate
CID 99851619
2-methylpropyl 4-(3-methylbutanoylamino)piperidine-1-carboxylate
CID 108559419
2-methylpropyl 4-(propanoylamino)piperidine-1-carboxylate
CID 108562132
2-methylpropyl 4-propan-2-ylpiperidine-1-carboxylate
CID 21025591
2-methylpropyl 4-[[(1R,2R)-2-(hydroxymethyl)cyclopentyl]amino]piperidine-1-carboxylate
CID 97056288
2-methylpropyl 4-[(2,2-dimethyl-6-oxopiperidin-3-yl)amino]piperidine-1-carboxylate
CID 126799155
butyl 4-(cyclopropylamino)piperidine-1-carboxylate
CID 151751894
2-methylpropyl 3-aminopyrrolidine-1-carboxylate
CID 62067213
2-methylpropyl (3R)-3-aminopyrrolidine-1-carboxylate
CID 94340136
ethane;2-methylpropyl 4-[(1-acetylpiperidin-4-yl)methyl]piperidine-1-carboxylate
CID 171073059
ethyl 4-[(4-carbamoylcyclohexyl)amino]piperidine-1-carboxylate
CID 43791646

Frequently Asked Questions

What is the IUPAC name of 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate?
The IUPAC name of 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate (CID 69398316) is 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate.
What is the SMILES notation for 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate?
The canonical SMILES for 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate is CC(C)COC(=O)N1CCC(NC2CC2)CC1.
What is the InChIKey of 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate?
The InChIKey is COZCSVSEBVWFTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10(2)9-17-13(16)15-7-5-12(6-8-15)14-11-3-4-11/h10-12,14H,3-9H2,1-2H3.
What are the key properties of 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate?
2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate has a molecular weight of 240.35 g/mol, XLogP of 2.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropyl 4-(cyclopropylamino)piperidine-1-carboxylate is sourced from PubChem (CID 69398316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).