CID 171589235

C12H28N3Sn — CID 171589235

IUPAC—
SMILESCC(C)CN1C(C)N(CC(C)C)[Sn]1N(C)C
InChIInChI=1S/C10H22N2.C2H6N.Sn/c1-8(2)6-11-10(5)12-7-9(3)4;1-3-2;/h8-10H,6-7H2,1-5H3;1-2H3;/q-2;-1;+3
InChIKeyBEEGOACYEDDNEQ-UHFFFAOYSA-N
MW333.09 g/mol
LogP1.81
Rot. Bonds5

About CID 171589235

CID 171589235 (PubChem CID 171589235) has the molecular formula C12H28N3Sn and a molecular weight of 333.09 g/mol.

Molecular Properties

Compound NameCID 171589235
PubChem CID171589235
Molecular FormulaC12H28N3Sn
Molecular Weight333.09 g/mol
Exact Mass334.13
IUPAC Name—
SMILESCC(C)CN1C(C)N(CC(C)C)[Sn]1N(C)C
InChIInChI=1S/C10H22N2.C2H6N.Sn/c1-8(2)6-11-10(5)12-7-9(3)4;1-3-2;/h8-10H,6-7H2,1-5H3;1-2H3;/q-2;-1;+3
InChIKeyBEEGOACYEDDNEQ-UHFFFAOYSA-N
XLogP1.81
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.09
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 171589240
CID 171589240
3,5-dimethyl-1-(2-methylpropyl)piperidine
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CID 138728386
methane;N-methyl-N,1-bis(2-methylpropyl)piperidin-4-amine
CID 162017171
1-amino-N-methyl-N-[1-(2-methylpropyl)piperidin-4-yl]ethanesulfonamide
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CID 59045042
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1,3,5-tris(2-methylpropyl)triazinane
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Frequently Asked Questions

What is the IUPAC name of CID 171589235?
The IUPAC name of CID 171589235 (CID 171589235) is not available.
What is the SMILES notation for CID 171589235?
The canonical SMILES for CID 171589235 is CC(C)CN1C(C)N(CC(C)C)[Sn]1N(C)C.
What is the InChIKey of CID 171589235?
The InChIKey is BEEGOACYEDDNEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2.C2H6N.Sn/c1-8(2)6-11-10(5)12-7-9(3)4;1-3-2;/h8-10H,6-7H2,1-5H3;1-2H3;/q-2;-1;+3.
What are the key properties of CID 171589235?
CID 171589235 has a molecular weight of 333.09 g/mol, XLogP of 1.81, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 171589235 is sourced from PubChem (CID 171589235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).