2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine

C15H27N5 — CID 107053119

IUPAC2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
SMILESCn1nnc(CC2(CNC(C)(C)C)CC3CCC2C3)n1
InChIInChI=1S/C15H27N5/c1-14(2,3)16-10-15(8-11-5-6-12(15)7-11)9-13-17-19-20(4)18-13/h11-12,16H,5-10H2,1-4H3
InChIKeyCVVISGQYUUMFKI-UHFFFAOYSA-N
MW277.42 g/mol
LogP1.95
Rot. Bonds4

About 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine

2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine (PubChem CID 107053119) has the molecular formula C15H27N5 and a molecular weight of 277.42 g/mol. Its IUPAC name is 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine.

Molecular Properties

Compound Name2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
PubChem CID107053119
Molecular FormulaC15H27N5
Molecular Weight277.42 g/mol
Exact Mass277.23
IUPAC Name2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine
SMILESCn1nnc(CC2(CNC(C)(C)C)CC3CCC2C3)n1
InChIInChI=1S/C15H27N5/c1-14(2,3)16-10-15(8-11-5-6-12(15)7-11)9-13-17-19-20(4)18-13/h11-12,16H,5-10H2,1-4H3
InChIKeyCVVISGQYUUMFKI-UHFFFAOYSA-N
XLogP1.95
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.42
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine?
The IUPAC name of 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine (CID 107053119) is 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine.
What is the SMILES notation for 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine?
The canonical SMILES for 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine is Cn1nnc(CC2(CNC(C)(C)C)CC3CCC2C3)n1.
What is the InChIKey of 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine?
The InChIKey is CVVISGQYUUMFKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N5/c1-14(2,3)16-10-15(8-11-5-6-12(15)7-11)9-13-17-19-20(4)18-13/h11-12,16H,5-10H2,1-4H3.
What are the key properties of 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine?
2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine has a molecular weight of 277.42 g/mol, XLogP of 1.95, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[2-[(2-methyltetrazol-5-yl)methyl]-2-bicyclo[2.2.1]heptanyl]methyl]propan-2-amine is sourced from PubChem (CID 107053119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).