N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride

C10H22ClN3 — CID 162304570

IUPACN,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride
SMILESCC(C)CN=C=NCCCN(C)C.Cl
InChIInChI=1S/C10H21N3.ClH/c1-10(2)8-12-9-11-6-5-7-13(3)4;/h10H,5-8H2,1-4H3;1H
InChIKeyOAPIEPRWLJPMQQ-UHFFFAOYSA-N
MW219.76 g/mol
LogP2.19
Rot. Bonds6

About N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride

N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride (PubChem CID 162304570) has the molecular formula C10H22ClN3 and a molecular weight of 219.76 g/mol. Its IUPAC name is N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride.

Molecular Properties

Compound NameN,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride
PubChem CID162304570
Molecular FormulaC10H22ClN3
Molecular Weight219.76 g/mol
Exact Mass219.15
IUPAC NameN,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride
SMILESCC(C)CN=C=NCCCN(C)C.Cl
InChIInChI=1S/C10H21N3.ClH/c1-10(2)8-12-9-11-6-5-7-13(3)4;/h10H,5-8H2,1-4H3;1H
InChIKeyOAPIEPRWLJPMQQ-UHFFFAOYSA-N
XLogP2.19
TPSA27.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.76
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

azane;3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;hydrochloride
CID 174499626
3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;silver;hydrochloride
CID 174929426
N,N-dimethyl-3-(propyliminomethylideneamino)propan-1-amine
CID 11480685
ethene;3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;hydrochloride
CID 87575427
azane;3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine
CID 146446789
3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;N-ethyl-N-propan-2-ylpropan-2-amine
CID 86755171
3-(2,2-dimethylpropyliminomethylideneamino)-N,N-dimethylpropan-1-amine
CID 174829721
3-isothiocyanato-N,N-dimethylpropan-1-amine;hydrochloride
CID 17365655
3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine
CID 135981086
3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;propan-2-one
CID 158337348
3-(ethyliminomethylideneamino)-N,N-dimethylpropan-1-amine;methylsulfinylmethane
CID 87433592
2-(butyliminomethylideneamino)-N,N-dimethylethanamine
CID 134871643

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride?
The IUPAC name of N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride (CID 162304570) is N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride.
What is the SMILES notation for N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride?
The canonical SMILES for N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride is CC(C)CN=C=NCCCN(C)C.Cl.
What is the InChIKey of N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride?
The InChIKey is OAPIEPRWLJPMQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3.ClH/c1-10(2)8-12-9-11-6-5-7-13(3)4;/h10H,5-8H2,1-4H3;1H.
What are the key properties of N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride?
N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride has a molecular weight of 219.76 g/mol, XLogP of 2.19, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(2-methylpropyliminomethylideneamino)propan-1-amine;hydrochloride is sourced from PubChem (CID 162304570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).