2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine

C10H15N3 — CID 130659210

IUPAC2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine
SMILESCC1CN(c2ncccn2)CC1C
InChIInChI=1S/C10H15N3/c1-8-6-13(7-9(8)2)10-11-4-3-5-12-10/h3-5,8-9H,6-7H2,1-2H3
InChIKeyIQEJCZHFKZJNTI-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.57
Rot. Bonds1

About 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine

2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine (PubChem CID 130659210) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine.

Molecular Properties

Compound Name2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine
PubChem CID130659210
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine
SMILESCC1CN(c2ncccn2)CC1C
InChIInChI=1S/C10H15N3/c1-8-6-13(7-9(8)2)10-11-4-3-5-12-10/h3-5,8-9H,6-7H2,1-2H3
InChIKeyIQEJCZHFKZJNTI-UHFFFAOYSA-N
XLogP1.57
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(3S,4S)-4-methyl-1-pyrimidin-2-ylpyrrolidine-3-carboxamide
CID 128980881
2-(3-propan-2-ylazetidin-1-yl)pyrimidine
CID 130933035
1-pyrimidin-2-ylazetidin-3-ol;hydrochloride
CID 155858524
2-(3-chloro-4-methylpiperidin-1-yl)pyrimidine
CID 102960793
2-(3-bromo-4-methylpiperidin-1-yl)pyrimidine
CID 102961086
3-pyrimidin-2-yl-3,6-diazabicyclo[3.1.1]heptane
CID 152707227
azane;2-(4-methylpiperidin-1-yl)pyrimidine
CID 70283358
(1S,5S)-8-propan-2-yl-3-pyrimidin-2-yl-3,8-diazabicyclo[3.2.1]octane
CID 98255752
2-(3-pyrazol-1-ylazetidin-1-yl)pyrimidine
CID 126900167
2-(1-pyrimidin-2-ylazetidin-3-yl)ethanamine
CID 130965270
(3R,4S)-4-propyl-1-pyrimidin-2-ylpyrrolidin-3-amine
CID 72922661
2,2,3,3,5,5,6,6-octadeuterio-1,4-di(pyrimidin-2-yl)piperazine
CID 162642408

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine?
The IUPAC name of 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine (CID 130659210) is 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine.
What is the SMILES notation for 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine?
The canonical SMILES for 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine is CC1CN(c2ncccn2)CC1C.
What is the InChIKey of 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine?
The InChIKey is IQEJCZHFKZJNTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-8-6-13(7-9(8)2)10-11-4-3-5-12-10/h3-5,8-9H,6-7H2,1-2H3.
What are the key properties of 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine?
2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine has a molecular weight of 177.25 g/mol, XLogP of 1.57, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylpyrrolidin-1-yl)pyrimidine is sourced from PubChem (CID 130659210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).