2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide

C17H25N3O — CID 43816897

IUPAC2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide
SMILESO=C(CNC1CC1)Nc1ccc(CN2CCCCC2)cc1
InChIInChI=1S/C17H25N3O/c21-17(12-18-15-8-9-15)19-16-6-4-14(5-7-16)13-20-10-2-1-3-11-20/h4-7,15,18H,1-3,8-13H2,(H,19,21)
InChIKeyKARNJDUYRDWAFI-UHFFFAOYSA-N
MW287.41 g/mol
LogP2.36
Rot. Bonds6

About 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide

2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide (PubChem CID 43816897) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide
PubChem CID43816897
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC Name2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide
SMILESO=C(CNC1CC1)Nc1ccc(CN2CCCCC2)cc1
InChIInChI=1S/C17H25N3O/c21-17(12-18-15-8-9-15)19-16-6-4-14(5-7-16)13-20-10-2-1-3-11-20/h4-7,15,18H,1-3,8-13H2,(H,19,21)
InChIKeyKARNJDUYRDWAFI-UHFFFAOYSA-N
XLogP2.36
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 52.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-benzylpiperidin-4-yl)amino]-N-(4-piperidin-1-ylsulfonylphenyl)acetamide chloride
CID 53351236
N-[2-oxo-2-[4-(piperidin-1-ylmethyl)anilino]ethyl]benzamide
CID 108761981
2-(propan-2-ylamino)-N-[4-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 60671103
3-bromo-N-[4-(piperidin-1-ylmethyl)phenyl]propanamide
CID 108739357
1,3-bis[4-(pyrrolidin-1-ylmethyl)phenyl]urea
CID 17464843
N-(4-chlorophenyl)-2-(cyclohexylamino)acetamide
CID 788648
N-[4-(piperidin-1-ylmethyl)phenyl]-2-(4-pyrrolidin-1-ylpiperidin-1-yl)acetamide
CID 46976904
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[4-(azepan-1-ylmethyl)phenyl]acetamide
CID 119867943
4-hydroxy-N-[4-(pyrrolidin-1-ylmethyl)phenyl]butanamide
CID 79200789
2-(methylamino)-N-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]acetamide
CID 120703837
2-pyrrolidin-2-yl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 61365999
N-[4-(pyrrolidin-1-ylmethyl)phenyl]pentanamide
CID 3292281

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide?
The IUPAC name of 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide (CID 43816897) is 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide.
What is the SMILES notation for 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide?
The canonical SMILES for 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide is O=C(CNC1CC1)Nc1ccc(CN2CCCCC2)cc1.
What is the InChIKey of 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide?
The InChIKey is KARNJDUYRDWAFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c21-17(12-18-15-8-9-15)19-16-6-4-14(5-7-16)13-20-10-2-1-3-11-20/h4-7,15,18H,1-3,8-13H2,(H,19,21).
What are the key properties of 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide?
2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide has a molecular weight of 287.41 g/mol, XLogP of 2.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylamino)-N-[4-(piperidin-1-ylmethyl)phenyl]acetamide is sourced from PubChem (CID 43816897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).