2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine

C10H17N5 — CID 106022717

IUPAC2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine
SMILESCN1CCCC1CNc1ncc(N)cn1
InChIInChI=1S/C10H17N5/c1-15-4-2-3-9(15)7-14-10-12-5-8(11)6-13-10/h5-6,9H,2-4,7,11H2,1H3,(H,12,13,14)
InChIKeyHKXYTYJIMSJUJN-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.56
Rot. Bonds3

About 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine

2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine (PubChem CID 106022717) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine.

Molecular Properties

Compound Name2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine
PubChem CID106022717
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine
SMILESCN1CCCC1CNc1ncc(N)cn1
InChIInChI=1S/C10H17N5/c1-15-4-2-3-9(15)7-14-10-12-5-8(11)6-13-10/h5-6,9H,2-4,7,11H2,1H3,(H,12,13,14)
InChIKeyHKXYTYJIMSJUJN-UHFFFAOYSA-N
XLogP0.56
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-2-amine
CID 103724805
2-N-[(1-ethylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine
CID 61146431
2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,4-diamine
CID 106028625
2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrazine-2,5-diamine
CID 106028605
5-bromo-2-hydrazinyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidin-4-amine
CID 106026101
4-N-methyl-2-N-[(1-methylpyrrolidin-2-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 142876099
6-chloro-2-N-[(1-methylpyrrolidin-2-yl)methyl]pyridine-2,4-diamine
CID 106022889
1-methyl-N-[[(2R)-1-methylpyrrolidin-2-yl]methyl]pyrazol-4-amine
CID 155225172
5-chloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyrazin-2-amine
CID 131214051
2-[(1-methylpiperidin-2-yl)methoxy]pyrimidin-5-amine
CID 65472450
3,5-dichloro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine
CID 106026698
5-fluoro-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-2-amine
CID 106026754

Frequently Asked Questions

What is the IUPAC name of 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine?
The IUPAC name of 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine (CID 106022717) is 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine.
What is the SMILES notation for 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine?
The canonical SMILES for 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine is CN1CCCC1CNc1ncc(N)cn1.
What is the InChIKey of 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine?
The InChIKey is HKXYTYJIMSJUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-15-4-2-3-9(15)7-14-10-12-5-8(11)6-13-10/h5-6,9H,2-4,7,11H2,1H3,(H,12,13,14).
What are the key properties of 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine?
2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine has a molecular weight of 207.28 g/mol, XLogP of 0.56, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[(1-methylpyrrolidin-2-yl)methyl]pyrimidine-2,5-diamine is sourced from PubChem (CID 106022717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).