1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol

C15H26N4O — CID 77083595

IUPAC1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol
SMILESCCNc1ncc(CN(C)CCC2(O)CCCC2)cn1
InChIInChI=1S/C15H26N4O/c1-3-16-14-17-10-13(11-18-14)12-19(2)9-8-15(20)6-4-5-7-15/h10-11,20H,3-9,12H2,1-2H3,(H,16,17,18)
InChIKeySICHNDNREVGVPG-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.04
Rot. Bonds7

About 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol

1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol (PubChem CID 77083595) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol
PubChem CID77083595
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol
SMILESCCNc1ncc(CN(C)CCC2(O)CCCC2)cn1
InChIInChI=1S/C15H26N4O/c1-3-16-14-17-10-13(11-18-14)12-19(2)9-8-15(20)6-4-5-7-15/h10-11,20H,3-9,12H2,1-2H3,(H,16,17,18)
InChIKeySICHNDNREVGVPG-UHFFFAOYSA-N
XLogP2.04
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol?
The IUPAC name of 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol (CID 77083595) is 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol?
The canonical SMILES for 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol is CCNc1ncc(CN(C)CCC2(O)CCCC2)cn1.
What is the InChIKey of 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol?
The InChIKey is SICHNDNREVGVPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-3-16-14-17-10-13(11-18-14)12-19(2)9-8-15(20)6-4-5-7-15/h10-11,20H,3-9,12H2,1-2H3,(H,16,17,18).
What are the key properties of 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol?
1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol has a molecular weight of 278.40 g/mol, XLogP of 2.04, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[2-(ethylamino)pyrimidin-5-yl]methyl-methylamino]ethyl]cyclopentan-1-ol is sourced from PubChem (CID 77083595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).