4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine

C10H17N5 — CID 80828220

IUPAC4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine
SMILESCN(C)C1CCN(c2ccnc(N)n2)C1
InChIInChI=1S/C10H17N5/c1-14(2)8-4-6-15(7-8)9-3-5-12-10(11)13-9/h3,5,8H,4,6-7H2,1-2H3,(H2,11,12,13)
InChIKeySQACQVQSDHOIPA-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.20
Rot. Bonds2

About 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine

4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine (PubChem CID 80828220) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine.

Molecular Properties

Compound Name4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine
PubChem CID80828220
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine
SMILESCN(C)C1CCN(c2ccnc(N)n2)C1
InChIInChI=1S/C10H17N5/c1-14(2)8-4-6-15(7-8)9-3-5-12-10(11)13-9/h3,5,8H,4,6-7H2,1-2H3,(H2,11,12,13)
InChIKeySQACQVQSDHOIPA-UHFFFAOYSA-N
XLogP0.20
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[3-(dimethylamino)piperidin-1-yl]pyrimidin-2-amine
CID 80856327
4-[3-(diethylamino)pyrrolidin-1-yl]pyrimidin-2-amine
CID 80827694
4-[(3S)-3-aminopyrrolidin-1-yl]pyrimidin-2-amine
CID 59631602
4-[3-(dimethylamino)pyrrolidin-1-yl]-N-methylpyrimidin-2-amine
CID 80827872
4-(3-methoxypyrrolidin-1-yl)pyrimidin-2-amine
CID 103541763
1-(2-aminopyrimidin-4-yl)pyrrolidine-3-carboxylic acid
CID 178108022
4-[3-(methoxymethyl)pyrrolidin-1-yl]pyrimidin-2-amine
CID 80845282
1-[6-(aminomethyl)-2-pyridinyl]-N,N-dimethylpyrrolidin-3-amine
CID 63168924
4-(azetidin-1-yl)pyrimidin-2-amine
CID 118975953
N,N-dimethyl-1-(4-methylpyrimidin-2-yl)pyrrolidin-3-amine
CID 123144666
4-(4-ethoxypiperidin-1-yl)pyrimidin-2-amine
CID 80798046
4-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 25128833

Frequently Asked Questions

What is the IUPAC name of 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine?
The IUPAC name of 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine (CID 80828220) is 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine.
What is the SMILES notation for 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine?
The canonical SMILES for 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine is CN(C)C1CCN(c2ccnc(N)n2)C1.
What is the InChIKey of 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine?
The InChIKey is SQACQVQSDHOIPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-14(2)8-4-6-15(7-8)9-3-5-12-10(11)13-9/h3,5,8H,4,6-7H2,1-2H3,(H2,11,12,13).
What are the key properties of 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine?
4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine has a molecular weight of 207.28 g/mol, XLogP of 0.20, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(dimethylamino)pyrrolidin-1-yl]pyrimidin-2-amine is sourced from PubChem (CID 80828220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).