N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine

C10H19N5 — CID 107053103

IUPACN-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine
SMILESCn1nnc(CC(C)(C)CNC2CC2)n1
InChIInChI=1S/C10H19N5/c1-10(2,7-11-8-4-5-8)6-9-12-14-15(3)13-9/h8,11H,4-7H2,1-3H3
InChIKeyYJNZJMJJERNRMF-UHFFFAOYSA-N
MW209.30 g/mol
LogP0.53
Rot. Bonds5

About N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine

N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine (PubChem CID 107053103) has the molecular formula C10H19N5 and a molecular weight of 209.30 g/mol. Its IUPAC name is N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine
PubChem CID107053103
Molecular FormulaC10H19N5
Molecular Weight209.30 g/mol
Exact Mass209.16
IUPAC NameN-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine
SMILESCn1nnc(CC(C)(C)CNC2CC2)n1
InChIInChI=1S/C10H19N5/c1-10(2,7-11-8-4-5-8)6-9-12-14-15(3)13-9/h8,11H,4-7H2,1-3H3
InChIKeyYJNZJMJJERNRMF-UHFFFAOYSA-N
XLogP0.53
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.30
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine?
The IUPAC name of N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine (CID 107053103) is N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine.
What is the SMILES notation for N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine?
The canonical SMILES for N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine is Cn1nnc(CC(C)(C)CNC2CC2)n1.
What is the InChIKey of N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine?
The InChIKey is YJNZJMJJERNRMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5/c1-10(2,7-11-8-4-5-8)6-9-12-14-15(3)13-9/h8,11H,4-7H2,1-3H3.
What are the key properties of N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine?
N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine has a molecular weight of 209.30 g/mol, XLogP of 0.53, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-dimethyl-3-(2-methyltetrazol-5-yl)propyl]cyclopropanamine is sourced from PubChem (CID 107053103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).