N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide

C13H26N2O — CID 62210682

IUPACN-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide
SMILESCCC(C)N(C)C(=O)CCC1CCNCC1
InChIInChI=1S/C13H26N2O/c1-4-11(2)15(3)13(16)6-5-12-7-9-14-10-8-12/h11-12,14H,4-10H2,1-3H3
InChIKeyZMJZQSACNODRDS-UHFFFAOYSA-N
MW226.36 g/mol
LogP2.02
Rot. Bonds5

About N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide

N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide (PubChem CID 62210682) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide.

Molecular Properties

Compound NameN-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide
PubChem CID62210682
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide
SMILESCCC(C)N(C)C(=O)CCC1CCNCC1
InChIInChI=1S/C13H26N2O/c1-4-11(2)15(3)13(16)6-5-12-7-9-14-10-8-12/h11-12,14H,4-10H2,1-3H3
InChIKeyZMJZQSACNODRDS-UHFFFAOYSA-N
XLogP2.02
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-methyl-3-piperidin-4-yl-N-propan-2-ylpropanamide
CID 62211368
N-methyl-N-(3-methylbutan-2-yl)-3-piperidin-4-ylpropanamide
CID 62210167
2-[butan-2-yl(3-piperidin-4-ylpropanoyl)amino]acetic acid
CID 62210937
N-butan-2-yl-N-methyl-3-piperidin-4-yloxypropanamide
CID 63875957
N-butan-2-yl-4-cyclohexyl-N-methylbutanamide
CID 112817760
3-(3-aminocyclohexyl)-N-butan-2-yl-N-methylpropanamide
CID 80701676
2-[methyl(3-piperidin-4-ylpropanoyl)amino]acetic acid
CID 62212379
N-[2-(dimethylamino)ethyl]-N-methyl-3-piperidin-4-ylpropanamide
CID 55227726
5-methyl-1-piperidin-4-ylheptan-3-one
CID 116563326
3-cyclopropyl-N-methyl-N-piperidin-4-ylpropanamide
CID 119441464
N-(1-bromopropan-2-yl)-3-cyclohexyl-N-methylpropanamide
CID 104556269
N-ethyl-3-piperidin-4-yl-N-propylpropanamide
CID 62210157

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide?
The IUPAC name of N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide (CID 62210682) is N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide.
What is the SMILES notation for N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide?
The canonical SMILES for N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide is CCC(C)N(C)C(=O)CCC1CCNCC1.
What is the InChIKey of N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide?
The InChIKey is ZMJZQSACNODRDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-4-11(2)15(3)13(16)6-5-12-7-9-14-10-8-12/h11-12,14H,4-10H2,1-3H3.
What are the key properties of N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide?
N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide has a molecular weight of 226.36 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-N-methyl-3-piperidin-4-ylpropanamide is sourced from PubChem (CID 62210682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).