1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine

C10H19N5S — CID 64650320

IUPAC1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine
SMILESCCNC(CC)CSc1nnnn1C1CC1
InChIInChI=1S/C10H19N5S/c1-3-8(11-4-2)7-16-10-12-13-14-15(10)9-5-6-9/h8-9,11H,3-7H2,1-2H3
InChIKeyUZLOBLZJVJQMEV-UHFFFAOYSA-N
MW241.36 g/mol
LogP1.49
Rot. Bonds7

About 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine

1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine (PubChem CID 64650320) has the molecular formula C10H19N5S and a molecular weight of 241.36 g/mol. Its IUPAC name is 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine.

Molecular Properties

Compound Name1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine
PubChem CID64650320
Molecular FormulaC10H19N5S
Molecular Weight241.36 g/mol
Exact Mass241.14
IUPAC Name1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine
SMILESCCNC(CC)CSc1nnnn1C1CC1
InChIInChI=1S/C10H19N5S/c1-3-8(11-4-2)7-16-10-12-13-14-15(10)9-5-6-9/h8-9,11H,3-7H2,1-2H3
InChIKeyUZLOBLZJVJQMEV-UHFFFAOYSA-N
XLogP1.49
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.36
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-(1-cyclopentyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine
CID 64648734
N-[2-(1-cyclopropyltetrazol-5-yl)sulfanylethyl]propan-2-amine
CID 61386414
1-(1-cyclopropyltetrazol-5-yl)sulfanylpentan-2-amine
CID 64649342
3-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylheptan-4-amine
CID 64648752
1-(1-cyclopentyltetrazol-5-yl)sulfanylpropan-2-amine
CID 64649517
4-(1-cyclopropyltetrazol-5-yl)sulfanyl-2-(propylamino)butanenitrile
CID 55145079
N-[2-(1-cyclopentyltetrazol-5-yl)sulfanylethyl]propan-2-amine
CID 61386323
1-(1-cyclopentyltetrazol-5-yl)sulfanyl-3,3-dimethyl-N-propylbutan-2-amine
CID 64649712
5-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-propylpentan-2-amine
CID 64648944
methyl 4-(1-cyclopentyltetrazol-5-yl)sulfanyl-2-(ethylamino)butanoate
CID 63035729
1-cyclopropyl-5-(3,3-diethoxypropylsulfanyl)tetrazole
CID 63628121
2-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-methylpentan-3-amine
CID 64647783

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine?
The IUPAC name of 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine (CID 64650320) is 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine.
What is the SMILES notation for 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine?
The canonical SMILES for 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine is CCNC(CC)CSc1nnnn1C1CC1.
What is the InChIKey of 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine?
The InChIKey is UZLOBLZJVJQMEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5S/c1-3-8(11-4-2)7-16-10-12-13-14-15(10)9-5-6-9/h8-9,11H,3-7H2,1-2H3.
What are the key properties of 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine?
1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine has a molecular weight of 241.36 g/mol, XLogP of 1.49, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-ethylbutan-2-amine is sourced from PubChem (CID 64650320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).