4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide

C11H23N3O — CID 81458117

IUPAC4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide
SMILESCCC1CN(C(=O)NC(C)C)CCC1N
InChIInChI=1S/C11H23N3O/c1-4-9-7-14(6-5-10(9)12)11(15)13-8(2)3/h8-10H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyXHWAYRIGOVPDAE-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.16
Rot. Bonds2

About 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide

4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide (PubChem CID 81458117) has the molecular formula C11H23N3O and a molecular weight of 213.32 g/mol. Its IUPAC name is 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide
PubChem CID81458117
Molecular FormulaC11H23N3O
Molecular Weight213.32 g/mol
Exact Mass213.18
IUPAC Name4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide
SMILESCCC1CN(C(=O)NC(C)C)CCC1N
InChIInChI=1S/C11H23N3O/c1-4-9-7-14(6-5-10(9)12)11(15)13-8(2)3/h8-10H,4-7,12H2,1-3H3,(H,13,15)
InChIKeyXHWAYRIGOVPDAE-UHFFFAOYSA-N
XLogP1.16
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(3R,4S)-4-amino-3-ethylpiperidin-1-yl]-2-methylpropan-1-one
CID 96581965
1-[(3S,4R)-4-amino-3-ethylpiperidin-1-yl]-2-methylpropan-1-one
CID 96581968
4-amino-3-ethylpiperidine-1-carboxylic acid
CID 90001260
1-[(3R,4S)-4-amino-3-ethylpiperidin-1-yl]propan-1-one
CID 96581961
N,3-di(propan-2-yl)pyrrolidine-1-carboxamide;molecular hydrogen
CID 169182520
1-(4-amino-3-ethylpiperidin-1-yl)prop-2-yn-1-one
CID 81456843
3-amino-4-methyl-N-propan-2-ylpyrrolidine-1-carboxamide
CID 103576202
3-(methylamino)-N-propan-2-ylpyrrolidine-1-carboxamide
CID 83697103
4-amino-N,3-diethyl-N-methylpiperidine-1-carboxamide
CID 81456883
2-(4-amino-3-ethylpiperidin-1-yl)-1-pyrrolidin-1-ylpropan-1-one
CID 81459438
9-methyl-N-propan-2-yl-3,9-diazabicyclo[4.2.1]nonane-3-carboxamide
CID 115667395
1-(4-amino-3-ethylpiperidin-1-yl)-4-methoxy-3-methylbutan-1-one
CID 81458526

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide?
The IUPAC name of 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide (CID 81458117) is 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide?
The canonical SMILES for 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide is CCC1CN(C(=O)NC(C)C)CCC1N.
What is the InChIKey of 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide?
The InChIKey is XHWAYRIGOVPDAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O/c1-4-9-7-14(6-5-10(9)12)11(15)13-8(2)3/h8-10H,4-7,12H2,1-3H3,(H,13,15).
What are the key properties of 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide?
4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide has a molecular weight of 213.32 g/mol, XLogP of 1.16, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-ethyl-N-propan-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 81458117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).