2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide

C13H27N3O — CID 63636253

IUPAC2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide
SMILESCCN(C1CCCNC1)C(C)C(=O)NC(C)C
InChIInChI=1S/C13H27N3O/c1-5-16(12-7-6-8-14-9-12)11(4)13(17)15-10(2)3/h10-12,14H,5-9H2,1-4H3,(H,15,17)
InChIKeyRCQMZDVFYBQXSW-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.97
Rot. Bonds5

About 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide

2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide (PubChem CID 63636253) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide.

Molecular Properties

Compound Name2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide
PubChem CID63636253
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC Name2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide
SMILESCCN(C1CCCNC1)C(C)C(=O)NC(C)C
InChIInChI=1S/C13H27N3O/c1-5-16(12-7-6-8-14-9-12)11(4)13(17)15-10(2)3/h10-12,14H,5-9H2,1-4H3,(H,15,17)
InChIKeyRCQMZDVFYBQXSW-UHFFFAOYSA-N
XLogP0.97
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-tert-butyl-2-[ethyl(piperidin-3-yl)amino]propanamide
CID 55244726
2-[ethyl(piperidin-3-yl)amino]-N-pentylpropanamide
CID 63638698
2-[azetidin-3-yl(ethyl)amino]-N-butan-2-ylpropanamide
CID 66181522
3-[ethyl(piperidin-3-yl)amino]-2-methylbutanoic acid
CID 79413481
N-(ethylcarbamoyl)-2-[piperidin-3-yl(propyl)amino]propanamide
CID 63637325
methyl 2-[ethyl(pyrrolidin-3-yl)amino]propanoate
CID 63299827
N-ethyl-N-(3-methylbutan-2-yl)piperidin-3-amine
CID 63644152
N-butan-2-yl-2-[propyl(pyrrolidin-3-yl)amino]propanamide
CID 63304037
N-methyl-2-[methyl(piperidin-3-yl)amino]propanamide
CID 63643925
N,N-diethyl-2-[methyl(piperidin-3-yl)amino]propanamide
CID 55248539
N-(1-cyclopropylpropyl)-N-ethylpiperidin-3-amine
CID 64917233
2-[azetidin-3-yl(ethyl)amino]-N-prop-2-ynylpropanamide
CID 66181972

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide?
The IUPAC name of 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide (CID 63636253) is 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide.
What is the SMILES notation for 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide?
The canonical SMILES for 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide is CCN(C1CCCNC1)C(C)C(=O)NC(C)C.
What is the InChIKey of 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide?
The InChIKey is RCQMZDVFYBQXSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-5-16(12-7-6-8-14-9-12)11(4)13(17)15-10(2)3/h10-12,14H,5-9H2,1-4H3,(H,15,17).
What are the key properties of 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide?
2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide has a molecular weight of 241.38 g/mol, XLogP of 0.97, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl(piperidin-3-yl)amino]-N-propan-2-ylpropanamide is sourced from PubChem (CID 63636253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).