4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride

C15H24ClN5O — CID 3073352

IUPAC4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride
SMILESC1CCC(c2nc(NC3CC3)nc(N3CCOCC3)n2)C1.Cl
InChIInChI=1S/C15H23N5O.ClH/c1-2-4-11(3-1)13-17-14(16-12-5-6-12)19-15(18-13)20-7-9-21-10-8-20;/h11-12H,1-10H2,(H,16,17,18,19);1H
InChIKeyQNRHCRWCPMOUSS-UHFFFAOYSA-N
MW325.84 g/mol
LogP2.36
Rot. Bonds4

About 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride

4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride (PubChem CID 3073352) has the molecular formula C15H24ClN5O and a molecular weight of 325.84 g/mol. Its IUPAC name is 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride.

Molecular Properties

Compound Name4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride
PubChem CID3073352
Molecular FormulaC15H24ClN5O
Molecular Weight325.84 g/mol
Exact Mass325.17
IUPAC Name4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride
SMILESC1CCC(c2nc(NC3CC3)nc(N3CCOCC3)n2)C1.Cl
InChIInChI=1S/C15H23N5O.ClH/c1-2-4-11(3-1)13-17-14(16-12-5-6-12)19-15(18-13)20-7-9-21-10-8-20;/h11-12H,1-10H2,(H,16,17,18,19);1H
InChIKeyQNRHCRWCPMOUSS-UHFFFAOYSA-N
XLogP2.36
TPSA63.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.84
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride?
The IUPAC name of 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride (CID 3073352) is 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride.
What is the SMILES notation for 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride?
The canonical SMILES for 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride is C1CCC(c2nc(NC3CC3)nc(N3CCOCC3)n2)C1.Cl.
What is the InChIKey of 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride?
The InChIKey is QNRHCRWCPMOUSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O.ClH/c1-2-4-11(3-1)13-17-14(16-12-5-6-12)19-15(18-13)20-7-9-21-10-8-20;/h11-12H,1-10H2,(H,16,17,18,19);1H.
What are the key properties of 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride?
4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride has a molecular weight of 325.84 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-cyclopropyl-6-morpholin-4-yl-1,3,5-triazin-2-amine;hydrochloride is sourced from PubChem (CID 3073352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).