N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide

C16H25N3O — CID 43683597

IUPACN-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide
SMILESCCCN1CCC(Nc2ccc(C(=O)NC)cc2)CC1
InChIInChI=1S/C16H25N3O/c1-3-10-19-11-8-15(9-12-19)18-14-6-4-13(5-7-14)16(20)17-2/h4-7,15,18H,3,8-12H2,1-2H3,(H,17,20)
InChIKeyHAYGREGFWHGDIK-UHFFFAOYSA-N
MW275.40 g/mol
LogP2.33
Rot. Bonds5

About N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide

N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide (PubChem CID 43683597) has the molecular formula C16H25N3O and a molecular weight of 275.40 g/mol. Its IUPAC name is N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide.

Molecular Properties

Compound NameN-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide
PubChem CID43683597
Molecular FormulaC16H25N3O
Molecular Weight275.40 g/mol
Exact Mass275.20
IUPAC NameN-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide
SMILESCCCN1CCC(Nc2ccc(C(=O)NC)cc2)CC1
InChIInChI=1S/C16H25N3O/c1-3-10-19-11-8-15(9-12-19)18-14-6-4-13(5-7-14)16(20)17-2/h4-7,15,18H,3,8-12H2,1-2H3,(H,17,20)
InChIKeyHAYGREGFWHGDIK-UHFFFAOYSA-N
XLogP2.33
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(1-propylpiperidin-4-yl)amino]phenyl]propanamide
CID 43720611
N-methyl-4-[(1-propylpiperidin-4-yl)amino]pyridine-2-carboxamide
CID 60703936
N-methyl-4-(thian-4-ylamino)benzamide
CID 43683708
2-chloro-4-[(1-propylpiperidin-4-yl)amino]benzamide
CID 43736426
4-[(4-tert-butylcyclohexyl)amino]-N-methylbenzamide
CID 43683594
N-methyl-4-(pyrrolidin-3-ylamino)benzamide
CID 79723972
4-[(1-acetylpiperidin-4-yl)amino]-N-ethylbenzamide
CID 43787652
N-(1-propylpiperidin-4-yl)pyridine-4-carboxamide
CID 17249951
N-(4-methylsulfonylphenyl)-1-propylazepan-4-amine
CID 65072534
4-[[(1-ethylpiperidin-4-yl)amino]methyl]-N-methylbenzamide
CID 28620099
N-[4-(difluoromethylsulfanyl)phenyl]-1-propylpiperidin-4-amine
CID 43673068
1-propyl-N-[4-(tetrazol-1-yl)phenyl]piperidin-4-amine
CID 28621696

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide?
The IUPAC name of N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide (CID 43683597) is N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide.
What is the SMILES notation for N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide?
The canonical SMILES for N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide is CCCN1CCC(Nc2ccc(C(=O)NC)cc2)CC1.
What is the InChIKey of N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide?
The InChIKey is HAYGREGFWHGDIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3O/c1-3-10-19-11-8-15(9-12-19)18-14-6-4-13(5-7-14)16(20)17-2/h4-7,15,18H,3,8-12H2,1-2H3,(H,17,20).
What are the key properties of N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide?
N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide has a molecular weight of 275.40 g/mol, XLogP of 2.33, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-[(1-propylpiperidin-4-yl)amino]benzamide is sourced from PubChem (CID 43683597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).