6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine

C8H16N2 — CID 167037379

IUPAC6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine
SMILESCC(C)C1=C(N)CCCN1
InChIInChI=1S/C8H16N2/c1-6(2)8-7(9)4-3-5-10-8/h6,10H,3-5,9H2,1-2H3
InChIKeyKOJNPAQNNYBNLB-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.20
Rot. Bonds1

About 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine

6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine (PubChem CID 167037379) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine.

Molecular Properties

Compound Name6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine
PubChem CID167037379
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine
SMILESCC(C)C1=C(N)CCCN1
InChIInChI=1S/C8H16N2/c1-6(2)8-7(9)4-3-5-10-8/h6,10H,3-5,9H2,1-2H3
InChIKeyKOJNPAQNNYBNLB-UHFFFAOYSA-N
XLogP1.20
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine?
The IUPAC name of 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine (CID 167037379) is 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine.
What is the SMILES notation for 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine?
The canonical SMILES for 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine is CC(C)C1=C(N)CCCN1.
What is the InChIKey of 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine?
The InChIKey is KOJNPAQNNYBNLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-6(2)8-7(9)4-3-5-10-8/h6,10H,3-5,9H2,1-2H3.
What are the key properties of 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine?
6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine has a molecular weight of 140.23 g/mol, XLogP of 1.20, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-1,2,3,4-tetrahydropyridin-5-amine is sourced from PubChem (CID 167037379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).