N,3-dimethyl-3-phosphanylheptan-1-amine

C9H22NP — CID 134182050

IUPACN,3-dimethyl-3-phosphanylheptan-1-amine
SMILESCCCCC(C)(P)CCNC
InChIInChI=1S/C9H22NP/c1-4-5-6-9(2,11)7-8-10-3/h10H,4-8,11H2,1-3H3
InChIKeyDDQJSWVKQRZHPK-UHFFFAOYSA-N
MW175.26 g/mol
LogP2.42
Rot. Bonds6

About N,3-dimethyl-3-phosphanylheptan-1-amine

N,3-dimethyl-3-phosphanylheptan-1-amine (PubChem CID 134182050) has the molecular formula C9H22NP and a molecular weight of 175.26 g/mol. Its IUPAC name is N,3-dimethyl-3-phosphanylheptan-1-amine.

Molecular Properties

Compound NameN,3-dimethyl-3-phosphanylheptan-1-amine
PubChem CID134182050
Molecular FormulaC9H22NP
Molecular Weight175.26 g/mol
Exact Mass175.15
IUPAC NameN,3-dimethyl-3-phosphanylheptan-1-amine
SMILESCCCCC(C)(P)CCNC
InChIInChI=1S/C9H22NP/c1-4-5-6-9(2,11)7-8-10-3/h10H,4-8,11H2,1-3H3
InChIKeyDDQJSWVKQRZHPK-UHFFFAOYSA-N
XLogP2.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.26
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

N,3,3-trimethyldecan-1-amine
CID 81022297
N,3,3-trimethylpentadecan-1-amine
CID 81023479
1-N,3-dimethylhenicosane-1,3-diamine
CID 175200070
N-methylbutan-1-amine
CID 8068
N-methyltridecan-1-amine;molecular hydrogen
CID 153363446
1-N,3-N,3-trimethylhexane-1,3-diamine
CID 123347800
3-(2-aminoethyl)-3-butylpentane-1,5-diamine;3,3-bis(2-aminoethyl)pentane-1,5-diamine;3,3-dibutyl-N,N'-dimethylpentane-1,5-diamine;N-methylthiohydroxylamine;thionitrosomethane
CID 157267479
N-methyltriacontan-1-amine
CID 19840895
ethane;N-methylbutan-1-amine;propane
CID 142092371
N-methylheptan-1-amine;molecular hydrogen;propane
CID 144955567
ethane;3-ethyl-N,3-dimethylpentan-1-amine
CID 156646079
3-buta-2,3-dien-2-yl-N,3,5,5-tetramethylnonan-1-amine
CID 91229920

Frequently Asked Questions

What is the IUPAC name of N,3-dimethyl-3-phosphanylheptan-1-amine?
The IUPAC name of N,3-dimethyl-3-phosphanylheptan-1-amine (CID 134182050) is N,3-dimethyl-3-phosphanylheptan-1-amine.
What is the SMILES notation for N,3-dimethyl-3-phosphanylheptan-1-amine?
The canonical SMILES for N,3-dimethyl-3-phosphanylheptan-1-amine is CCCCC(C)(P)CCNC.
What is the InChIKey of N,3-dimethyl-3-phosphanylheptan-1-amine?
The InChIKey is DDQJSWVKQRZHPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22NP/c1-4-5-6-9(2,11)7-8-10-3/h10H,4-8,11H2,1-3H3.
What are the key properties of N,3-dimethyl-3-phosphanylheptan-1-amine?
N,3-dimethyl-3-phosphanylheptan-1-amine has a molecular weight of 175.26 g/mol, XLogP of 2.42, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-dimethyl-3-phosphanylheptan-1-amine is sourced from PubChem (CID 134182050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).