2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine

C14H27N5 — CID 79349924

IUPAC2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine
SMILESCC(C)CNCc1nnnn1CC1C(C)(C)C1(C)C
InChIInChI=1S/C14H27N5/c1-10(2)7-15-8-12-16-17-18-19(12)9-11-13(3,4)14(11,5)6/h10-11,15H,7-9H2,1-6H3
InChIKeyPCIBBJJJIOOBCC-UHFFFAOYSA-N
MW265.40 g/mol
LogP2.10
Rot. Bonds6

About 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine

2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine (PubChem CID 79349924) has the molecular formula C14H27N5 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine
PubChem CID79349924
Molecular FormulaC14H27N5
Molecular Weight265.40 g/mol
Exact Mass265.23
IUPAC Name2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine
SMILESCC(C)CNCc1nnnn1CC1C(C)(C)C1(C)C
InChIInChI=1S/C14H27N5/c1-10(2)7-15-8-12-16-17-18-19(12)9-11-13(3,4)14(11,5)6/h10-11,15H,7-9H2,1-6H3
InChIKeyPCIBBJJJIOOBCC-UHFFFAOYSA-N
XLogP2.10
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine (CID 79349924) is 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine is CC(C)CNCc1nnnn1CC1C(C)(C)C1(C)C.
What is the InChIKey of 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine?
The InChIKey is PCIBBJJJIOOBCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5/c1-10(2)7-15-8-12-16-17-18-19(12)9-11-13(3,4)14(11,5)6/h10-11,15H,7-9H2,1-6H3.
What are the key properties of 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine?
2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine has a molecular weight of 265.40 g/mol, XLogP of 2.10, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[[1-[(2,2,3,3-tetramethylcyclopropyl)methyl]tetrazol-5-yl]methyl]propan-1-amine is sourced from PubChem (CID 79349924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).