N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide

C13H27N3O — CID 43400111

IUPACN-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide
SMILESCCCN1CCC(NC(C)C(=O)NCC)CC1
InChIInChI=1S/C13H27N3O/c1-4-8-16-9-6-12(7-10-16)15-11(3)13(17)14-5-2/h11-12,15H,4-10H2,1-3H3,(H,14,17)
InChIKeyBVAXHLGFALFTQB-UHFFFAOYSA-N
MW241.38 g/mol
LogP0.98
Rot. Bonds6

About N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide

N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide (PubChem CID 43400111) has the molecular formula C13H27N3O and a molecular weight of 241.38 g/mol. Its IUPAC name is N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide.

Molecular Properties

Compound NameN-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide
PubChem CID43400111
Molecular FormulaC13H27N3O
Molecular Weight241.38 g/mol
Exact Mass241.22
IUPAC NameN-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide
SMILESCCCN1CCC(NC(C)C(=O)NCC)CC1
InChIInChI=1S/C13H27N3O/c1-4-8-16-9-6-12(7-10-16)15-11(3)13(17)14-5-2/h11-12,15H,4-10H2,1-3H3,(H,14,17)
InChIKeyBVAXHLGFALFTQB-UHFFFAOYSA-N
XLogP0.98
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.38
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-[(1-ethylpiperidin-4-yl)amino]propanamide
CID 43400100
N-propyl-2-[(1-propylazepan-4-yl)amino]propanamide
CID 65074258
N-(3-methoxypropyl)-2-[(1-propylpiperidin-4-yl)amino]propanamide
CID 60722361
N-ethyl-2-[(1-ethylazepan-4-yl)amino]propanamide
CID 65074151
2-[(1-propylpiperidin-4-yl)amino]propanamide
CID 43401252
1-piperidin-1-yl-2-[(1-propylpiperidin-4-yl)amino]propan-1-one
CID 60677287
methyl 2-methyl-3-[(1-propylpiperidin-4-yl)amino]butanoate
CID 79392073
(2S)-2-amino-N-(1-propylpiperidin-4-yl)propanamide;dihydrochloride
CID 119834930
(2R)-2-amino-N-(1-propylpiperidin-4-yl)propanamide;dihydrochloride
CID 119834920
N-(3-methylbutyl)-2-[(1-methylpiperidin-4-yl)amino]propanamide
CID 43373502
3-methyl-2-[(1-propylazepan-4-yl)amino]butanoic acid
CID 65073293
2-[(1-methylpiperidin-4-yl)amino]-N-prop-2-ynylpropanamide
CID 43373498

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide?
The IUPAC name of N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide (CID 43400111) is N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide.
What is the SMILES notation for N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide?
The canonical SMILES for N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide is CCCN1CCC(NC(C)C(=O)NCC)CC1.
What is the InChIKey of N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide?
The InChIKey is BVAXHLGFALFTQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N3O/c1-4-8-16-9-6-12(7-10-16)15-11(3)13(17)14-5-2/h11-12,15H,4-10H2,1-3H3,(H,14,17).
What are the key properties of N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide?
N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide has a molecular weight of 241.38 g/mol, XLogP of 0.98, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(1-propylpiperidin-4-yl)amino]propanamide is sourced from PubChem (CID 43400111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).