N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide

C13H25N3O — CID 63248525

IUPACN-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
SMILESCNCC1CCN(CC(=O)NCC2CC2)CC1
InChIInChI=1S/C13H25N3O/c1-14-8-12-4-6-16(7-5-12)10-13(17)15-9-11-2-3-11/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyGKLRJMOSSXSOEV-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.44
Rot. Bonds6

About N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide

N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide (PubChem CID 63248525) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
PubChem CID63248525
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
SMILESCNCC1CCN(CC(=O)NCC2CC2)CC1
InChIInChI=1S/C13H25N3O/c1-14-8-12-4-6-16(7-5-12)10-13(17)15-9-11-2-3-11/h11-12,14H,2-10H2,1H3,(H,15,17)
InChIKeyGKLRJMOSSXSOEV-UHFFFAOYSA-N
XLogP0.44
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-2-[4-(ethylaminomethyl)piperidin-1-yl]acetamide
CID 63848050
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(methylcarbamoyl)acetamide;hydrochloride
CID 119922349
2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63248963
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(3-methylbutan-2-yl)acetamide
CID 63248872
N-cyclohexyl-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide;hydrochloride
CID 119922360
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(4-methylcyclohexyl)acetamide
CID 63248834
2-[4-(methylaminomethyl)piperidin-1-yl]-N-(6-methylheptan-2-yl)acetamide
CID 63248800
N,N-diethyl-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide
CID 63249005
propan-2-yl 2-[4-(methylaminomethyl)piperidin-1-yl]acetate
CID 63248775
N-(cyclohexylmethyl)-2-(4-methylpiperazin-1-yl)acetamide
CID 1459544
2-[4-(2-aminoethoxy)piperidin-1-yl]-N-(cyclopropylmethyl)acetamide
CID 82693316
1-[2-(cyclohexylmethylamino)-2-oxoethyl]piperidine-4-carboxylic acid
CID 119907812

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide (CID 63248525) is N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide is CNCC1CCN(CC(=O)NCC2CC2)CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide?
The InChIKey is GKLRJMOSSXSOEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-14-8-12-4-6-16(7-5-12)10-13(17)15-9-11-2-3-11/h11-12,14H,2-10H2,1H3,(H,15,17).
What are the key properties of N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide?
N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide has a molecular weight of 239.36 g/mol, XLogP of 0.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[4-(methylaminomethyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 63248525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).