3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide

C13H25N3O — CID 106639726

IUPAC3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide
SMILESCNC(=O)CCN(CC1CCCNC1)C1CC1
InChIInChI=1S/C13H25N3O/c1-14-13(17)6-8-16(12-4-5-12)10-11-3-2-7-15-9-11/h11-12,15H,2-10H2,1H3,(H,14,17)
InChIKeyAWNZPJQIYWBGCG-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.59
Rot. Bonds6

About 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide

3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide (PubChem CID 106639726) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide.

Molecular Properties

Compound Name3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide
PubChem CID106639726
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC Name3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide
SMILESCNC(=O)CCN(CC1CCCNC1)C1CC1
InChIInChI=1S/C13H25N3O/c1-14-13(17)6-8-16(12-4-5-12)10-11-3-2-7-15-9-11/h11-12,15H,2-10H2,1H3,(H,14,17)
InChIKeyAWNZPJQIYWBGCG-UHFFFAOYSA-N
XLogP0.59
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 ≤ 50.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-prop-2-ynylacetamide
CID 106639554
2-[cyclopropyl(piperidin-3-ylmethyl)amino]-N,N-dimethylacetamide
CID 106639825
N-(2-ethylsulfonylethyl)-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106640099
4-[cyclopropyl(piperidin-3-ylmethyl)amino]-2-methylbutan-2-ol
CID 106640266
N-cyclohexyl-2-[cyclopropyl(piperidin-3-ylmethyl)amino]acetamide
CID 106639591
N-(2-methylsulfanylethyl)-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106639574
N-hexyl-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106624769
6-[cyclopropyl(piperidin-3-ylmethyl)amino]hexan-1-ol
CID 107705718
N-(cycloheptylmethyl)-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106625038
N-(2-ethoxyethyl)-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106639978
N-cyclopropyl-3-(dimethylamino)-N-(piperidin-3-ylmethyl)propanamide
CID 106628487
N-methyl-2-[2-piperidin-3-ylethyl(propyl)amino]acetamide
CID 62356510

Frequently Asked Questions

What is the IUPAC name of 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide?
The IUPAC name of 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide (CID 106639726) is 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide.
What is the SMILES notation for 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide?
The canonical SMILES for 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide is CNC(=O)CCN(CC1CCCNC1)C1CC1.
What is the InChIKey of 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide?
The InChIKey is AWNZPJQIYWBGCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-14-13(17)6-8-16(12-4-5-12)10-11-3-2-7-15-9-11/h11-12,15H,2-10H2,1H3,(H,14,17).
What are the key properties of 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide?
3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide has a molecular weight of 239.36 g/mol, XLogP of 0.59, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclopropyl(piperidin-3-ylmethyl)amino]-N-methylpropanamide is sourced from PubChem (CID 106639726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).