N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine

C9H16N4 — CID 106552565

IUPACN,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine
SMILESCc1cnc(N(C)C2CCNC2)[nH]1
InChIInChI=1S/C9H16N4/c1-7-5-11-9(12-7)13(2)8-3-4-10-6-8/h5,8,10H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyKEHNDLQHELEZOL-UHFFFAOYSA-N
MW180.25 g/mol
LogP0.52
Rot. Bonds2

About N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine

N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine (PubChem CID 106552565) has the molecular formula C9H16N4 and a molecular weight of 180.25 g/mol. Its IUPAC name is N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine.

Molecular Properties

Compound NameN,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine
PubChem CID106552565
Molecular FormulaC9H16N4
Molecular Weight180.25 g/mol
Exact Mass180.14
IUPAC NameN,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine
SMILESCc1cnc(N(C)C2CCNC2)[nH]1
InChIInChI=1S/C9H16N4/c1-7-5-11-9(12-7)13(2)8-3-4-10-6-8/h5,8,10H,3-4,6H2,1-2H3,(H,11,12)
InChIKeyKEHNDLQHELEZOL-UHFFFAOYSA-N
XLogP0.52
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 50.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N,2-dimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 83844947
N,5,6-trimethyl-N-pyrrolidin-3-ylpyrimidin-4-amine
CID 83833515
5-fluoro-N-methyl-N-pyrrolidin-3-ylpyridin-2-amine
CID 63301481
5-methoxy-N,2-dimethyl-N-pyrrolidin-3-ylpyridin-4-amine
CID 106660833
N,4-dimethyl-N-[(3R)-pyrrolidin-3-yl]pyridin-2-amine;hydrochloride
CID 71640984
N-methyl-N-[(3R)-pyrrolidin-3-yl]-1,3-thiazol-2-amine;hydrochloride
CID 71641002
N-methyl-5-(3-methylphenyl)-N-pyrrolidin-3-ylpyrimidin-2-amine
CID 116977522
N,5,6-trimethyl-N-pyrrolidin-3-ylthieno[2,3-d]pyrimidin-4-amine
CID 63301843
N-methyl-N-[(3R)-pyrrolidin-3-yl]quinoxalin-2-amine;hydrochloride
CID 71641013
N-(4-tert-butyl-2-methylphenyl)-N-methylpyrrolidin-3-amine
CID 115118753
4-chloro-N,1-dimethyl-N-[(3R)-pyrrolidin-3-yl]pyrazol-5-amine
CID 70892352
N-methyl-N-(5-methylfuran-2-yl)pyrrolidin-3-amine
CID 115118775

Frequently Asked Questions

What is the IUPAC name of N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine?
The IUPAC name of N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine (CID 106552565) is N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine.
What is the SMILES notation for N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine?
The canonical SMILES for N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine is Cc1cnc(N(C)C2CCNC2)[nH]1.
What is the InChIKey of N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine?
The InChIKey is KEHNDLQHELEZOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4/c1-7-5-11-9(12-7)13(2)8-3-4-10-6-8/h5,8,10H,3-4,6H2,1-2H3,(H,11,12).
What are the key properties of N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine?
N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine has a molecular weight of 180.25 g/mol, XLogP of 0.52, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,5-dimethyl-N-pyrrolidin-3-yl-1H-imidazol-2-amine is sourced from PubChem (CID 106552565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).