CID 102140339

C15H17N4 — CID 102140339

IUPAC—
SMILESNCCN1[CH]N(Cc2ccccn2)c2ccccc21
InChIInChI=1S/C15H17N4/c16-8-10-18-12-19(11-13-5-3-4-9-17-13)15-7-2-1-6-14(15)18/h1-7,9,12H,8,10-11,16H2
InChIKeyPSIPCBYFJCMDGX-UHFFFAOYSA-N
MW253.33 g/mol
LogP1.99
Rot. Bonds4

About CID 102140339

CID 102140339 (PubChem CID 102140339) has the molecular formula C15H17N4 and a molecular weight of 253.33 g/mol.

Molecular Properties

Compound NameCID 102140339
PubChem CID102140339
Molecular FormulaC15H17N4
Molecular Weight253.33 g/mol
Exact Mass253.15
IUPAC Name—
SMILESNCCN1[CH]N(Cc2ccccn2)c2ccccc21
InChIInChI=1S/C15H17N4/c16-8-10-18-12-19(11-13-5-3-4-9-17-13)15-7-2-1-6-14(15)18/h1-7,9,12H,8,10-11,16H2
InChIKeyPSIPCBYFJCMDGX-UHFFFAOYSA-N
XLogP1.99
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.33
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

CID 102253209
CID 102253209
ethane;pyridin-2-ylmethanamine
CID 90791011
[1-(pyridin-2-ylmethyl)-1,2,4-triazol-3-yl]methanamine
CID 62949782
2-[5-(pyridin-2-ylmethyl)tetrazol-1-yl]ethanamine
CID 61372954
2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]aniline
CID 19626880
[4-(pyridin-2-ylmethyl)-1,2,4-triazol-3-yl]methanamine
CID 82468720
2-[(2-ethylazetidin-1-yl)methyl]pyridine
CID 130678024
1-(2-pyridin-2-ylethyl)-1,2,4-triazol-3-amine
CID 60910683
N'-[1-(pyridin-2-ylmethyl)piperidin-4-yl]ethane-1,2-diamine
CID 142667116
2-[1-(2-pyridin-2-ylethyl)-2,3-dihydroindol-3-yl]ethanamine
CID 63236194
(8aR)-2-methyl-7-(pyridin-2-ylmethyl)-5,6,8,8a-tetrahydro-1H-imidazo[1,5-a]pyrazin-3-one
CID 75537104
4-(pyridin-2-ylmethyl)-2H-[1,3]oxazolo[4,5-b]pyridin-2-ol
CID 126629243

Frequently Asked Questions

What is the IUPAC name of CID 102140339?
The IUPAC name of CID 102140339 (CID 102140339) is not available.
What is the SMILES notation for CID 102140339?
The canonical SMILES for CID 102140339 is NCCN1[CH]N(Cc2ccccn2)c2ccccc21.
What is the InChIKey of CID 102140339?
The InChIKey is PSIPCBYFJCMDGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N4/c16-8-10-18-12-19(11-13-5-3-4-9-17-13)15-7-2-1-6-14(15)18/h1-7,9,12H,8,10-11,16H2.
What are the key properties of CID 102140339?
CID 102140339 has a molecular weight of 253.33 g/mol, XLogP of 1.99, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for CID 102140339 is sourced from PubChem (CID 102140339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).