4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine

C14H26N4 — CID 114530411

IUPAC4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine
SMILESCn1ccnc1CCC(N)C(C)(C)N1CCCC1
InChIInChI=1S/C14H26N4/c1-14(2,18-9-4-5-10-18)12(15)6-7-13-16-8-11-17(13)3/h8,11-12H,4-7,9-10,15H2,1-3H3
InChIKeyYDRIWRCINBMUGB-UHFFFAOYSA-N
MW250.39 g/mol
LogP1.55
Rot. Bonds5

About 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine

4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine (PubChem CID 114530411) has the molecular formula C14H26N4 and a molecular weight of 250.39 g/mol. Its IUPAC name is 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine.

Molecular Properties

Compound Name4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine
PubChem CID114530411
Molecular FormulaC14H26N4
Molecular Weight250.39 g/mol
Exact Mass250.22
IUPAC Name4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine
SMILESCn1ccnc1CCC(N)C(C)(C)N1CCCC1
InChIInChI=1S/C14H26N4/c1-14(2,18-9-4-5-10-18)12(15)6-7-13-16-8-11-17(13)3/h8,11-12H,4-7,9-10,15H2,1-3H3
InChIKeyYDRIWRCINBMUGB-UHFFFAOYSA-N
XLogP1.55
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine 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

4-ethyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylhexan-3-amine
CID 114530442
N,4-dimethyl-1-(1-methylimidazol-2-yl)-4-piperidin-1-ylpentan-3-amine
CID 114530416
N,4-dimethyl-1-(1-methylimidazol-2-yl)-4-piperidin-1-ylhexan-3-amine
CID 114530433
1-methyl-2-(3-methylbutyl)imidazole
CID 68983412
N,3-dimethyl-1-(1-methylimidazol-2-yl)-3-piperidin-1-ylbutan-2-amine
CID 79761018
1-cyclopentyl-3-(1-methylimidazol-2-yl)propan-1-amine
CID 114530015
4-ethyl-4-methoxy-1-(1-methylimidazol-2-yl)hexan-3-amine
CID 114530777
1,1-difluoro-4-(1-methylimidazol-2-yl)butan-2-amine
CID 103517203
1-(7-bicyclo[4.1.0]heptanyl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 105050153
3-methyl-1-(1-methylimidazol-2-yl)-3-morpholin-4-ylpentan-2-amine
CID 79761529
1-[1-amino-3-(1-methylimidazol-2-yl)propyl]-N,N-dimethylcyclohexan-1-amine
CID 114530454
[4-methyl-1-(1-methylimidazol-2-yl)-4-morpholin-4-ylhexan-3-yl]hydrazine
CID 105241557

Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine?
The IUPAC name of 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine (CID 114530411) is 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine.
What is the SMILES notation for 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine?
The canonical SMILES for 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine is Cn1ccnc1CCC(N)C(C)(C)N1CCCC1.
What is the InChIKey of 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine?
The InChIKey is YDRIWRCINBMUGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4/c1-14(2,18-9-4-5-10-18)12(15)6-7-13-16-8-11-17(13)3/h8,11-12H,4-7,9-10,15H2,1-3H3.
What are the key properties of 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine?
4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine has a molecular weight of 250.39 g/mol, XLogP of 1.55, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(1-methylimidazol-2-yl)-4-pyrrolidin-1-ylpentan-3-amine is sourced from PubChem (CID 114530411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).