2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide

C14H29N3O — CID 20813690

IUPAC2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide
SMILESCC(C)NC(C)(C)C(=O)NCCC1CCCN1C
InChIInChI=1S/C14H29N3O/c1-11(2)16-14(3,4)13(18)15-9-8-12-7-6-10-17(12)5/h11-12,16H,6-10H2,1-5H3,(H,15,18)
InChIKeyHMIFARCEZXVJAU-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.36
Rot. Bonds6

About 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide

2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide (PubChem CID 20813690) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide.

Molecular Properties

Compound Name2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide
PubChem CID20813690
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide
SMILESCC(C)NC(C)(C)C(=O)NCCC1CCCN1C
InChIInChI=1S/C14H29N3O/c1-11(2)16-14(3,4)13(18)15-9-8-12-7-6-10-17(12)5/h11-12,16H,6-10H2,1-5H3,(H,15,18)
InChIKeyHMIFARCEZXVJAU-UHFFFAOYSA-N
XLogP1.36
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide?
The IUPAC name of 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide (CID 20813690) is 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide.
What is the SMILES notation for 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide?
The canonical SMILES for 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide is CC(C)NC(C)(C)C(=O)NCCC1CCCN1C.
What is the InChIKey of 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide?
The InChIKey is HMIFARCEZXVJAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-11(2)16-14(3,4)13(18)15-9-8-12-7-6-10-17(12)5/h11-12,16H,6-10H2,1-5H3,(H,15,18).
What are the key properties of 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide?
2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide has a molecular weight of 255.41 g/mol, XLogP of 1.36, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(1-methylpyrrolidin-2-yl)ethyl]-2-(propan-2-ylamino)propanamide is sourced from PubChem (CID 20813690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).