N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide

C13H25N3O — CID 61204430

IUPACN-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide
SMILESCNCC1CCCN(C(C)C(=O)NC2CC2)C1
InChIInChI=1S/C13H25N3O/c1-10(13(17)15-12-5-6-12)16-7-3-4-11(9-16)8-14-2/h10-12,14H,3-9H2,1-2H3,(H,15,17)
InChIKeyDJBQJDBYEDGRAF-UHFFFAOYSA-N
MW239.36 g/mol
LogP0.58
Rot. Bonds5

About N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide

N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide (PubChem CID 61204430) has the molecular formula C13H25N3O and a molecular weight of 239.36 g/mol. Its IUPAC name is N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide
PubChem CID61204430
Molecular FormulaC13H25N3O
Molecular Weight239.36 g/mol
Exact Mass239.20
IUPAC NameN-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide
SMILESCNCC1CCCN(C(C)C(=O)NC2CC2)C1
InChIInChI=1S/C13H25N3O/c1-10(13(17)15-12-5-6-12)16-7-3-4-11(9-16)8-14-2/h10-12,14H,3-9H2,1-2H3,(H,15,17)
InChIKeyDJBQJDBYEDGRAF-UHFFFAOYSA-N
XLogP0.58
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 50.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-2-[3-(methylaminomethyl)pyrrolidin-1-yl]propanamide;hydrochloride
CID 119922095
2-[[1-[1-(cyclopropylamino)-1-oxopropan-2-yl]piperidin-3-yl]methylamino]acetic acid
CID 106813810
N-cyclopentyl-2-[3-(ethylaminomethyl)piperidin-1-yl]propanamide
CID 63849664
N-butyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide
CID 61204053
2-methyl-3-[3-(methylaminomethyl)piperidin-1-yl]butanehydrazide
CID 79409445
2-[3-(2-aminoethyl)piperidin-1-yl]-N-cyclopentylpropanamide
CID 63764074
N-tert-butyl-2-[3-[(cyclopropylamino)methyl]piperidin-1-yl]propanamide
CID 63847259
2-(3-aminoazetidin-1-yl)-N-cyclopropylpropanamide
CID 63761129
2-[3-[(cyclopropylamino)methyl]piperidin-1-yl]-N-(ethylcarbamoyl)propanamide
CID 63848300
N-cyclopentyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]propanamide
CID 63853758
2-[3-(ethylaminomethyl)piperidin-1-yl]-N-propylpropanamide
CID 63849842
N-tert-butyl-2-[3-[(propan-2-ylamino)methyl]piperidin-1-yl]propanamide
CID 63241398

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide?
The IUPAC name of N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide (CID 61204430) is N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide?
The canonical SMILES for N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide is CNCC1CCCN(C(C)C(=O)NC2CC2)C1.
What is the InChIKey of N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide?
The InChIKey is DJBQJDBYEDGRAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O/c1-10(13(17)15-12-5-6-12)16-7-3-4-11(9-16)8-14-2/h10-12,14H,3-9H2,1-2H3,(H,15,17).
What are the key properties of N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide?
N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide has a molecular weight of 239.36 g/mol, XLogP of 0.58, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[3-(methylaminomethyl)piperidin-1-yl]propanamide is sourced from PubChem (CID 61204430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).