N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide

C12H23N3O — CID 106025328

IUPACN-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide
SMILESCC(NCC1CCCN1C)C(=O)NC1CC1
InChIInChI=1S/C12H23N3O/c1-9(12(16)14-10-5-6-10)13-8-11-4-3-7-15(11)2/h9-11,13H,3-8H2,1-2H3,(H,14,16)
InChIKeyQBHGMRGVDSMLPL-UHFFFAOYSA-N
MW225.34 g/mol
LogP0.34
Rot. Bonds5

About N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide

N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide (PubChem CID 106025328) has the molecular formula C12H23N3O and a molecular weight of 225.34 g/mol. Its IUPAC name is N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide.

Molecular Properties

Compound NameN-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide
PubChem CID106025328
Molecular FormulaC12H23N3O
Molecular Weight225.34 g/mol
Exact Mass225.18
IUPAC NameN-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide
SMILESCC(NCC1CCCN1C)C(=O)NC1CC1
InChIInChI=1S/C12H23N3O/c1-9(12(16)14-10-5-6-10)13-8-11-4-3-7-15(11)2/h9-11,13H,3-8H2,1-2H3,(H,14,16)
InChIKeyQBHGMRGVDSMLPL-UHFFFAOYSA-N
XLogP0.34
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.34
LogP ≤ 50.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 2-[(1-methylpyrrolidin-2-yl)methylamino]propanoate
CID 106020086
1-cyclohexyl-N-[(1-methylpyrrolidin-2-yl)methyl]ethanamine
CID 115676562
2-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]acetic acid
CID 106020198
methyl 2-methyl-3-[(1-methylpyrrolidin-2-yl)methylamino]butanoate
CID 106020245
N-cyclopentyl-2-(cyclopropylmethylamino)propanamide
CID 43116561
1-cyclobutyl-N-[(1-methylpyrrolidin-2-yl)methyl]propan-2-amine
CID 115712523
3-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]-2-sulfanylbutanamide
CID 106024016
N-cyclopropyl-2-(thian-2-ylmethylamino)propanamide
CID 80599814
N-cyclopropyl-2-[(2-hydroxycyclohexyl)methylamino]propanamide
CID 64913669
methyl 2-[(1-methylpyrrolidin-2-yl)methylamino]butanoate
CID 106024172
N-cyclopropyl-2-[(4-hydroxycyclohexyl)methylamino]propanamide
CID 114147898
N-[(1-methylpiperidin-2-yl)methyl]-2-sulfanylpropanamide
CID 107027013

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide?
The IUPAC name of N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide (CID 106025328) is N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide.
What is the SMILES notation for N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide?
The canonical SMILES for N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide is CC(NCC1CCCN1C)C(=O)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide?
The InChIKey is QBHGMRGVDSMLPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N3O/c1-9(12(16)14-10-5-6-10)13-8-11-4-3-7-15(11)2/h9-11,13H,3-8H2,1-2H3,(H,14,16).
What are the key properties of N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide?
N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide has a molecular weight of 225.34 g/mol, XLogP of 0.34, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-[(1-methylpyrrolidin-2-yl)methylamino]propanamide is sourced from PubChem (CID 106025328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).