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

C10H19N5 — CID 62763307

IUPACN-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine
SMILESCC(C)NCc1nnnn1C1CC1(C)C
InChIInChI=1S/C10H19N5/c1-7(2)11-6-9-12-13-14-15(9)8-5-10(8,3)4/h7-8,11H,5-6H2,1-4H3
InChIKeyDCOCQKNUPBDNRP-UHFFFAOYSA-N
MW209.30 g/mol
LogP1.14
Rot. Bonds4

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

N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine (PubChem CID 62763307) has the molecular formula C10H19N5 and a molecular weight of 209.30 g/mol. Its IUPAC name is N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine.

Molecular Properties

Compound NameN-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine
PubChem CID62763307
Molecular FormulaC10H19N5
Molecular Weight209.30 g/mol
Exact Mass209.16
IUPAC NameN-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine
SMILESCC(C)NCc1nnnn1C1CC1(C)C
InChIInChI=1S/C10H19N5/c1-7(2)11-6-9-12-13-14-15(9)8-5-10(8,3)4/h7-8,11H,5-6H2,1-4H3
InChIKeyDCOCQKNUPBDNRP-UHFFFAOYSA-N
XLogP1.14
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.30
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine?
The IUPAC name of N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine (CID 62763307) is N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine.
What is the SMILES notation for N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine?
The canonical SMILES for N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine is CC(C)NCc1nnnn1C1CC1(C)C.
What is the InChIKey of N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine?
The InChIKey is DCOCQKNUPBDNRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5/c1-7(2)11-6-9-12-13-14-15(9)8-5-10(8,3)4/h7-8,11H,5-6H2,1-4H3.
What are the key properties of N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine?
N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine has a molecular weight of 209.30 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(2,2-dimethylcyclopropyl)tetrazol-5-yl]methyl]propan-2-amine is sourced from PubChem (CID 62763307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).