sodium;N,N-dipropylpropan-1-amine;chloride

C9H21ClNNa — CID 175189857

IUPACsodium;N,N-dipropylpropan-1-amine;chloride
SMILESCCCN(CCC)CCC.[Cl-].[Na+]
InChIInChI=1S/C9H21N.ClH.Na/c1-4-7-10(8-5-2)9-6-3;;/h4-9H2,1-3H3;1H;/q;;+1/p-1
InChIKeyHABOOCBRENSDKJ-UHFFFAOYSA-M
MW201.72 g/mol
LogP-3.47
Rot. Bonds6

About sodium;N,N-dipropylpropan-1-amine;chloride

sodium;N,N-dipropylpropan-1-amine;chloride (PubChem CID 175189857) has the molecular formula C9H21ClNNa and a molecular weight of 201.72 g/mol. Its IUPAC name is sodium;N,N-dipropylpropan-1-amine;chloride.

Molecular Properties

Compound Namesodium;N,N-dipropylpropan-1-amine;chloride
PubChem CID175189857
Molecular FormulaC9H21ClNNa
Molecular Weight201.72 g/mol
Exact Mass201.13
IUPAC Namesodium;N,N-dipropylpropan-1-amine;chloride
SMILESCCCN(CCC)CCC.[Cl-].[Na+]
InChIInChI=1S/C9H21N.ClH.Na/c1-4-7-10(8-5-2)9-6-3;;/h4-9H2,1-3H3;1H;/q;;+1/p-1
InChIKeyHABOOCBRENSDKJ-UHFFFAOYSA-M
XLogP-3.47
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.72
LogP ≤ 5-3.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

copper;N,N,N',N'-tetrapropylethane-1,2-diamine;dichloride
CID 173220390
Tripropylamineborane
CID 21315686
N,N-dipropylpropan-1-amine;pentahydrochloride
CID 172789957
N,N-dipropylpropan-1-amine;propane
CID 174574210
N,N-diethylethanamine;N,N-dipropylpropan-1-amine
CID 22257187
copper;N,N,N',N'-tetrapropylethane-1,2-diamine;dibromide
CID 173220545
N-ethyl-N,N',N'-tripropylethane-1,2-diamine
CID 88655813
N,N-dipropylpropan-1-amine;propan-1-ol;hydrochloride
CID 173448711
N,N-dipropylbutan-1-amine;hydrofluoride
CID 19783533
N-(2-iodoethyl)-N-propylpropan-1-amine
CID 88928815
N,N-dipropylpropan-1-amine;methanone;2-methylpropane;ruthenium(4+)
CID 169317196
N-dodecyl-N-propylpentadecan-1-amine;tridecane
CID 177194050

Frequently Asked Questions

What is the IUPAC name of sodium;N,N-dipropylpropan-1-amine;chloride?
The IUPAC name of sodium;N,N-dipropylpropan-1-amine;chloride (CID 175189857) is sodium;N,N-dipropylpropan-1-amine;chloride.
What is the SMILES notation for sodium;N,N-dipropylpropan-1-amine;chloride?
The canonical SMILES for sodium;N,N-dipropylpropan-1-amine;chloride is CCCN(CCC)CCC.[Cl-].[Na+].
What is the InChIKey of sodium;N,N-dipropylpropan-1-amine;chloride?
The InChIKey is HABOOCBRENSDKJ-UHFFFAOYSA-M. The full InChI is InChI=1S/C9H21N.ClH.Na/c1-4-7-10(8-5-2)9-6-3;;/h4-9H2,1-3H3;1H;/q;;+1/p-1.
What are the key properties of sodium;N,N-dipropylpropan-1-amine;chloride?
sodium;N,N-dipropylpropan-1-amine;chloride has a molecular weight of 201.72 g/mol, XLogP of -3.47, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for sodium;N,N-dipropylpropan-1-amine;chloride is sourced from PubChem (CID 175189857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).