3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide

C11H21N3O — CID 115269980

IUPAC3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide
SMILESCC1(C)CCN(C(=O)NC2CC2)CC1N
InChIInChI=1S/C11H21N3O/c1-11(2)5-6-14(7-9(11)12)10(15)13-8-3-4-8/h8-9H,3-7,12H2,1-2H3,(H,13,15)
InChIKeyJNBJAHCFJRTCDR-UHFFFAOYSA-N
MW211.31 g/mol
LogP0.92
Rot. Bonds1

About 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide

3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide (PubChem CID 115269980) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide.

Molecular Properties

Compound Name3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide
PubChem CID115269980
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide
SMILESCC1(C)CCN(C(=O)NC2CC2)CC1N
InChIInChI=1S/C11H21N3O/c1-11(2)5-6-14(7-9(11)12)10(15)13-8-3-4-8/h8-9H,3-7,12H2,1-2H3,(H,13,15)
InChIKeyJNBJAHCFJRTCDR-UHFFFAOYSA-N
XLogP0.92
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide?
The IUPAC name of 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide (CID 115269980) is 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide.
What is the SMILES notation for 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide?
The canonical SMILES for 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide is CC1(C)CCN(C(=O)NC2CC2)CC1N.
What is the InChIKey of 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide?
The InChIKey is JNBJAHCFJRTCDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-11(2)5-6-14(7-9(11)12)10(15)13-8-3-4-8/h8-9H,3-7,12H2,1-2H3,(H,13,15).
What are the key properties of 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide?
3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide has a molecular weight of 211.31 g/mol, XLogP of 0.92, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-cyclopropyl-4,4-dimethylpiperidine-1-carboxamide is sourced from PubChem (CID 115269980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).