N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide

C15H31N3O — CID 114507937

IUPACN-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide
SMILESCCC1CN(C(C)C(=O)NC(C)(C)C)CCC1NC
InChIInChI=1S/C15H31N3O/c1-7-12-10-18(9-8-13(12)16-6)11(2)14(19)17-15(3,4)5/h11-13,16H,7-10H2,1-6H3,(H,17,19)
InChIKeyKDXSORLBNZZXKB-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.61
Rot. Bonds4

About N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide

N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide (PubChem CID 114507937) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide
PubChem CID114507937
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide
SMILESCCC1CN(C(C)C(=O)NC(C)(C)C)CCC1NC
InChIInChI=1S/C15H31N3O/c1-7-12-10-18(9-8-13(12)16-6)11(2)14(19)17-15(3,4)5/h11-13,16H,7-10H2,1-6H3,(H,17,19)
InChIKeyKDXSORLBNZZXKB-UHFFFAOYSA-N
XLogP1.61
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide
CID 114507912
2-[3-ethyl-4-(methylamino)piperidin-1-yl]-N-pentan-3-ylpropanamide
CID 114507963
3-[3-ethyl-4-(methylamino)piperidin-1-yl]butan-2-ol
CID 114507986
N-tert-butyl-2-[4-(methylaminomethyl)piperidin-1-yl]propanamide;hydrochloride
CID 119922516
methyl 1-[1-(tert-butylamino)-1-oxopropan-2-yl]piperidine-4-carboxylate
CID 60676690
2-[3-ethyl-4-(ethylamino)piperidin-1-yl]propanamide
CID 114507497
1-[3-ethyl-4-(methylamino)piperidin-1-yl]-2-methylbutan-1-one
CID 114506515
2-[3-ethyl-4-(propylamino)piperidin-1-yl]-N-(2-methoxyethyl)propanamide
CID 114507664
N-tert-butyl-2-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]propanamide
CID 63241398
3-ethyl-N,1-dimethylpiperidin-4-amine
CID 114507994
N-tert-butyl-2-[(3S)-3-methylpiperazin-1-yl]propanamide
CID 104976887
2-[3-(1-aminoethyl)piperidin-1-yl]-N-tert-butylpropanamide
CID 55258736

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide?
The IUPAC name of N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide (CID 114507937) is N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide.
What is the SMILES notation for N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide?
The canonical SMILES for N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide is CCC1CN(C(C)C(=O)NC(C)(C)C)CCC1NC.
What is the InChIKey of N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide?
The InChIKey is KDXSORLBNZZXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-7-12-10-18(9-8-13(12)16-6)11(2)14(19)17-15(3,4)5/h11-13,16H,7-10H2,1-6H3,(H,17,19).
What are the key properties of N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide?
N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide has a molecular weight of 269.43 g/mol, XLogP of 1.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-[3-ethyl-4-(methylamino)piperidin-1-yl]propanamide is sourced from PubChem (CID 114507937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).