N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide

C12H20N2O — CID 10750888

IUPACN-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide
SMILESCCCCC(=O)N(C)Cc1cccn1C
InChIInChI=1S/C12H20N2O/c1-4-5-8-12(15)14(3)10-11-7-6-9-13(11)2/h6-7,9H,4-5,8,10H2,1-3H3
InChIKeyROLBVXNMHAETCI-UHFFFAOYSA-N
MW208.31 g/mol
LogP2.17
Rot. Bonds5

About N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide

N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide (PubChem CID 10750888) has the molecular formula C12H20N2O and a molecular weight of 208.31 g/mol. Its IUPAC name is N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide.

Molecular Properties

Compound NameN-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide
PubChem CID10750888
Molecular FormulaC12H20N2O
Molecular Weight208.31 g/mol
Exact Mass208.16
IUPAC NameN-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide
SMILESCCCCC(=O)N(C)Cc1cccn1C
InChIInChI=1S/C12H20N2O/c1-4-5-8-12(15)14(3)10-11-7-6-9-13(11)2/h6-7,9H,4-5,8,10H2,1-3H3
InChIKeyROLBVXNMHAETCI-UHFFFAOYSA-N
XLogP2.17
TPSA25.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-N-[(1-methylpyrrol-2-yl)methyl]octanamide
CID 4041529
N-benzyl-N-methylpentanamide
CID 4629611
N-(3-methoxypropyl)-N-[(1-methylpyrrol-2-yl)methyl]dodecanamide
CID 42759885
N-methyl-N-[(1-methylpyrrol-2-yl)methyl]cyclopropanecarboxamide
CID 134792878
N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-propan-2-yloctanamide
CID 3502612
2-[acetyl(butan-2-yl)amino]-N-butyl-N-[(1-methylpyrrol-2-yl)methyl]acetamide
CID 42767446
N-butyl-2,2-dimethyl-N-[(1-methylpyrrol-2-yl)methyl]propanamide
CID 3647212
1-methyl-3-(2-methylphenyl)-1-[(1-methylpyrrol-2-yl)methyl]urea
CID 53016552
N-[2-[benzyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-N-[(2R)-butan-2-yl]hexanamide
CID 7216163
N-butyl-N-[(1-methylpyrrol-2-yl)methyl]-2-(propan-2-ylamino)acetamide
CID 42767351
2-(2-ethoxyethoxy)-N-methyl-N-[(1-methylpyrrol-2-yl)methyl]propanamide
CID 71850969
N-[2-[butyl-[(1-methylpyrrol-2-yl)methyl]amino]-2-oxoethyl]-3-chloro-2,2-dimethyl-N-propylpropanamide
CID 3398275

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide?
The IUPAC name of N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide (CID 10750888) is N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide.
What is the SMILES notation for N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide?
The canonical SMILES for N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide is CCCCC(=O)N(C)Cc1cccn1C.
What is the InChIKey of N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide?
The InChIKey is ROLBVXNMHAETCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-4-5-8-12(15)14(3)10-11-7-6-9-13(11)2/h6-7,9H,4-5,8,10H2,1-3H3.
What are the key properties of N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide?
N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide has a molecular weight of 208.31 g/mol, XLogP of 2.17, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[(1-methylpyrrol-2-yl)methyl]pentanamide is sourced from PubChem (CID 10750888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).