N,N-dipropylpropan-1-amine;toluene

C16H29N — CID 142167047

IUPACN,N-dipropylpropan-1-amine;toluene
SMILESCCCN(CCC)CCC.Cc1ccccc1
InChIInChI=1S/C9H21N.C7H8/c1-4-7-10(8-5-2)9-6-3;1-7-5-3-2-4-6-7/h4-9H2,1-3H3;2-6H,1H3
InChIKeyXHANQHULLRTETB-UHFFFAOYSA-N
MW235.42 g/mol
LogP4.51
Rot. Bonds6

About N,N-dipropylpropan-1-amine;toluene

N,N-dipropylpropan-1-amine;toluene (PubChem CID 142167047) has the molecular formula C16H29N and a molecular weight of 235.42 g/mol. Its IUPAC name is N,N-dipropylpropan-1-amine;toluene.

Molecular Properties

Compound NameN,N-dipropylpropan-1-amine;toluene
PubChem CID142167047
Molecular FormulaC16H29N
Molecular Weight235.42 g/mol
Exact Mass235.23
IUPAC NameN,N-dipropylpropan-1-amine;toluene
SMILESCCCN(CCC)CCC.Cc1ccccc1
InChIInChI=1S/C9H21N.C7H8/c1-4-7-10(8-5-2)9-6-3;1-7-5-3-2-4-6-7/h4-9H2,1-3H3;2-6H,1H3
InChIKeyXHANQHULLRTETB-UHFFFAOYSA-N
XLogP4.51
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.42
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of N,N-dipropylpropan-1-amine;toluene?
The IUPAC name of N,N-dipropylpropan-1-amine;toluene (CID 142167047) is N,N-dipropylpropan-1-amine;toluene.
What is the SMILES notation for N,N-dipropylpropan-1-amine;toluene?
The canonical SMILES for N,N-dipropylpropan-1-amine;toluene is CCCN(CCC)CCC.Cc1ccccc1.
What is the InChIKey of N,N-dipropylpropan-1-amine;toluene?
The InChIKey is XHANQHULLRTETB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N.C7H8/c1-4-7-10(8-5-2)9-6-3;1-7-5-3-2-4-6-7/h4-9H2,1-3H3;2-6H,1H3.
What are the key properties of N,N-dipropylpropan-1-amine;toluene?
N,N-dipropylpropan-1-amine;toluene has a molecular weight of 235.42 g/mol, XLogP of 4.51, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropylpropan-1-amine;toluene is sourced from PubChem (CID 142167047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).