CID 11642597

C13H20N2 — CID 11642597

IUPAC—
SMILESCC(C)N1C=C[C]C([C@@H]2CCCN2C)=C1
InChIInChI=1S/C13H20N2/c1-11(2)15-9-4-6-12(10-15)13-7-5-8-14(13)3/h4,9-11,13H,5,7-8H2,1-3H3/t13-/m0/s1
InChIKeyQODAIUYLRLPYPQ-ZDUSSCGKSA-N
MW204.32 g/mol
LogP2.28
Rot. Bonds2

About CID 11642597

CID 11642597 (PubChem CID 11642597) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol.

Molecular Properties

Compound NameCID 11642597
PubChem CID11642597
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC Name—
SMILESCC(C)N1C=C[C]C([C@@H]2CCCN2C)=C1
InChIInChI=1S/C13H20N2/c1-11(2)15-9-4-6-12(10-15)13-7-5-8-14(13)3/h4,9-11,13H,5,7-8H2,1-3H3/t13-/m0/s1
InChIKeyQODAIUYLRLPYPQ-ZDUSSCGKSA-N
XLogP2.28
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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5-(1-methylpyrrolidin-2-yl)-1-prop-1-ynyl-2H-pyridine
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2-(1-methylpyrrolidin-2-yl)pyrimidine
CID 89060530
5-(1-methylpyrrolidin-2-yl)-2-pyridin-2-ylpyridine
CID 22298167
1,2-dimethylpyrrolidine;methanol
CID 158560912
(2S)-2-(2,5-difluorophenyl)-1-methylpyrrolidine
CID 139526642
2-[2-(1-methylpyrrolidin-2-yl)-1,3-thiazol-5-yl]propan-1-amine
CID 115090518
2-benzhydryl-1-methylpyrrolidine
CID 71178925
2-(3,5-ditert-butylphenyl)-1-methylpyrrolidine
CID 102300432
methanol;3-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 174330723
5-(1-methylpyrrolidin-2-yl)pyridin-3-amine
CID 22336401
1-[5-(1-methylpyrrolidin-2-yl)-1H-imidazol-2-yl]ethanamine
CID 115019985

Frequently Asked Questions

What is the IUPAC name of CID 11642597?
The IUPAC name of CID 11642597 (CID 11642597) is not available.
What is the SMILES notation for CID 11642597?
The canonical SMILES for CID 11642597 is CC(C)N1C=C[C]C([C@@H]2CCCN2C)=C1.
What is the InChIKey of CID 11642597?
The InChIKey is QODAIUYLRLPYPQ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H20N2/c1-11(2)15-9-4-6-12(10-15)13-7-5-8-14(13)3/h4,9-11,13H,5,7-8H2,1-3H3/t13-/m0/s1.
What are the key properties of CID 11642597?
CID 11642597 has a molecular weight of 204.32 g/mol, XLogP of 2.28, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11642597 is sourced from PubChem (CID 11642597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).