ethane;2-propan-2-ylpentan-1-amine

C10H25N — CID 153346460

IUPACethane;2-propan-2-ylpentan-1-amine
SMILESCC.CCCC(CN)C(C)C
InChIInChI=1S/C8H19N.C2H6/c1-4-5-8(6-9)7(2)3;1-2/h7-8H,4-6,9H2,1-3H3;1-2H3
InChIKeyMULKNNIAJFESIZ-UHFFFAOYSA-N
MW159.32 g/mol
LogP3.04
Rot. Bonds4

About ethane;2-propan-2-ylpentan-1-amine

ethane;2-propan-2-ylpentan-1-amine (PubChem CID 153346460) has the molecular formula C10H25N and a molecular weight of 159.32 g/mol. Its IUPAC name is ethane;2-propan-2-ylpentan-1-amine.

Molecular Properties

Compound Nameethane;2-propan-2-ylpentan-1-amine
PubChem CID153346460
Molecular FormulaC10H25N
Molecular Weight159.32 g/mol
Exact Mass159.20
IUPAC Nameethane;2-propan-2-ylpentan-1-amine
SMILESCC.CCCC(CN)C(C)C
InChIInChI=1S/C8H19N.C2H6/c1-4-5-8(6-9)7(2)3;1-2/h7-8H,4-6,9H2,1-3H3;1-2H3
InChIKeyMULKNNIAJFESIZ-UHFFFAOYSA-N
XLogP3.04
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.32
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of ethane;2-propan-2-ylpentan-1-amine?
The IUPAC name of ethane;2-propan-2-ylpentan-1-amine (CID 153346460) is ethane;2-propan-2-ylpentan-1-amine.
What is the SMILES notation for ethane;2-propan-2-ylpentan-1-amine?
The canonical SMILES for ethane;2-propan-2-ylpentan-1-amine is CC.CCCC(CN)C(C)C.
What is the InChIKey of ethane;2-propan-2-ylpentan-1-amine?
The InChIKey is MULKNNIAJFESIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N.C2H6/c1-4-5-8(6-9)7(2)3;1-2/h7-8H,4-6,9H2,1-3H3;1-2H3.
What are the key properties of ethane;2-propan-2-ylpentan-1-amine?
ethane;2-propan-2-ylpentan-1-amine has a molecular weight of 159.32 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-propan-2-ylpentan-1-amine is sourced from PubChem (CID 153346460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).