N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide

C18H35N3O — CID 119859562

IUPACN-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide
SMILESCCCN1CCC(N(C)C(=O)CC(C)C2CCCNC2)CC1
InChIInChI=1S/C18H35N3O/c1-4-10-21-11-7-17(8-12-21)20(3)18(22)13-15(2)16-6-5-9-19-14-16/h15-17,19H,4-14H2,1-3H3
InChIKeyXQQALQUSCNHCRA-UHFFFAOYSA-N
MW309.50 g/mol
LogP2.35
Rot. Bonds6

About N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide

N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide (PubChem CID 119859562) has the molecular formula C18H35N3O and a molecular weight of 309.50 g/mol. Its IUPAC name is N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide.

Molecular Properties

Compound NameN-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide
PubChem CID119859562
Molecular FormulaC18H35N3O
Molecular Weight309.50 g/mol
Exact Mass309.28
IUPAC NameN-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide
SMILESCCCN1CCC(N(C)C(=O)CC(C)C2CCCNC2)CC1
InChIInChI=1S/C18H35N3O/c1-4-10-21-11-7-17(8-12-21)20(3)18(22)13-15(2)16-6-5-9-19-14-16/h15-17,19H,4-14H2,1-3H3
InChIKeyXQQALQUSCNHCRA-UHFFFAOYSA-N
XLogP2.35
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.50
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide
CID 81048676
N-methyl-3-piperidin-3-yl-N-propylbutanamide
CID 81043827
3-piperidin-3-yl-N,N-dipropylbutanamide
CID 81043811
2-(1,4-diazepan-1-yl)-N-methyl-N-(1-propylpiperidin-4-yl)acetamide
CID 62837819
N-(1-ethylpiperidin-4-yl)-N-methyl-3-piperidin-4-ylbutanamide
CID 119841958
N-(2,3-dihydro-1H-inden-2-yl)-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride
CID 119746195
N-butyl-N-methyl-3-piperidin-3-ylbutanamide;hydrochloride
CID 119672315
1-(3-piperidin-3-ylbutyl)-4-propan-2-ylpiperidine
CID 103497377
3-piperidin-3-yl-N-propan-2-yl-N-propylbutanamide
CID 81043730
N-methyl-N-(2-methylpropyl)-3-piperidin-3-ylbutanamide
CID 81043828
3-methyl-5-[methyl-(1-propylpiperidin-4-yl)amino]-5-oxopentanoic acid
CID 62963885
N-(1-methoxypropan-2-yl)-N-methyl-3-piperidin-3-ylbutanamide
CID 81043666

Frequently Asked Questions

What is the IUPAC name of N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide?
The IUPAC name of N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide (CID 119859562) is N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide.
What is the SMILES notation for N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide?
The canonical SMILES for N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide is CCCN1CCC(N(C)C(=O)CC(C)C2CCCNC2)CC1.
What is the InChIKey of N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide?
The InChIKey is XQQALQUSCNHCRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3O/c1-4-10-21-11-7-17(8-12-21)20(3)18(22)13-15(2)16-6-5-9-19-14-16/h15-17,19H,4-14H2,1-3H3.
What are the key properties of N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide?
N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide has a molecular weight of 309.50 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-piperidin-3-yl-N-(1-propylpiperidin-4-yl)butanamide is sourced from PubChem (CID 119859562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).