2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine

C9H15N5 — CID 126972390

IUPAC2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine
SMILESNc1ncnc(NCC2CCCC2)n1
InChIInChI=1S/C9H15N5/c10-8-12-6-13-9(14-8)11-5-7-3-1-2-4-7/h6-7H,1-5H2,(H3,10,11,12,13,14)
InChIKeyZVUIPFBXSRACMK-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.06
Rot. Bonds3

About 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine

2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine (PubChem CID 126972390) has the molecular formula C9H15N5 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine
PubChem CID126972390
Molecular FormulaC9H15N5
Molecular Weight193.25 g/mol
Exact Mass193.13
IUPAC Name2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine
SMILESNc1ncnc(NCC2CCCC2)n1
InChIInChI=1S/C9H15N5/c10-8-12-6-13-9(14-8)11-5-7-3-1-2-4-7/h6-7H,1-5H2,(H3,10,11,12,13,14)
InChIKeyZVUIPFBXSRACMK-UHFFFAOYSA-N
XLogP1.06
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-N-[(1-methylazetidin-3-yl)methyl]-1,3,5-triazine-2,4-diamine
CID 131025917
2-N,4-N-bis(cyclohexylmethyl)-1,3,5-triazine-2,4,6-triamine
CID 23290172
N-(cyclopropylmethyl)-4-methyl-1,3,5-triazin-2-amine
CID 91169316
N-(cyclopentylmethyl)pyrimidin-2-amine
CID 43317116
2-N-(cyclohexylmethyl)-6-phenyl-1,3,5-triazine-2,4-diamine
CID 139676139
2-N-(cyclopentylmethyl)-6-(trifluoromethyl)-1,3,5-triazine-2,4-diamine
CID 112746494
5-bromo-4-N-(cyclohexylmethyl)pyrimidine-2,4-diamine
CID 80784182
4-(2-tert-butylhydrazinyl)-N-(cyclopropylmethyl)-1,3,5-triazin-2-amine
CID 178081927
5-chloro-4-N-(cyclobutylmethyl)pyrimidine-2,4-diamine
CID 80783168
N-(cyclopentylmethyl)-4-methoxypyrimidin-2-amine
CID 112684482
N-(cyclopentylmethyl)quinazolin-2-amine
CID 114788866
2-N-(thiolan-3-yl)-1,3,5-triazine-2,4-diamine
CID 130532811

Frequently Asked Questions

What is the IUPAC name of 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine (CID 126972390) is 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine is Nc1ncnc(NCC2CCCC2)n1.
What is the InChIKey of 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is ZVUIPFBXSRACMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5/c10-8-12-6-13-9(14-8)11-5-7-3-1-2-4-7/h6-7H,1-5H2,(H3,10,11,12,13,14).
What are the key properties of 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine?
2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 193.25 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(cyclopentylmethyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 126972390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).