N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine

C10H21N2P — CID 139148682

IUPACN-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine
SMILESCC(C)P(NC1=NCCC1)C(C)C
InChIInChI=1S/C10H21N2P/c1-8(2)13(9(3)4)12-10-6-5-7-11-10/h8-9H,5-7H2,1-4H3,(H,11,12)
InChIKeyCEIWRBKLYWLSRW-UHFFFAOYSA-N
MW200.27 g/mol
LogP2.98
Rot. Bonds3

About N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine

N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine (PubChem CID 139148682) has the molecular formula C10H21N2P and a molecular weight of 200.27 g/mol. Its IUPAC name is N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine.

Molecular Properties

Compound NameN-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine
PubChem CID139148682
Molecular FormulaC10H21N2P
Molecular Weight200.27 g/mol
Exact Mass200.14
IUPAC NameN-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine
SMILESCC(C)P(NC1=NCCC1)C(C)C
InChIInChI=1S/C10H21N2P/c1-8(2)13(9(3)4)12-10-6-5-7-11-10/h8-9H,5-7H2,1-4H3,(H,11,12)
InChIKeyCEIWRBKLYWLSRW-UHFFFAOYSA-N
XLogP2.98
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.27
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(2S)-butan-2-yl]-3,4-dihydro-2H-pyrrol-5-amine
CID 55299481
N-(1-chloroethyl)-3,4-dihydro-2H-pyrrol-5-amine
CID 21397100
1-(3,4-dihydro-2H-pyrrol-5-ylamino)propan-2-ol
CID 79508010
N-(1-methoxy-3-methylbutan-2-yl)-3,4-dihydro-2H-pyrrol-5-amine
CID 79503143
1-(2,3,4,5-tetrahydropyridin-6-ylamino)propan-2-ol
CID 79508119
N-(4-methylpentan-2-yl)-2,3,4,5-tetrahydropyridin-6-amine
CID 79508440
2-N-(3,4-dihydro-2H-pyrrol-5-yl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 82939280
3-(2,3,4,5-tetrahydropyridin-6-ylamino)butan-1-ol
CID 83177293
N-ethyl-3,4-dihydro-2H-pyrrol-5-amine;hydrochloride
CID 67553216
N-(4-methylpentyl)-3,4,5,6-tetrahydro-2H-azepin-7-amine
CID 79006687
N-(2-propan-2-yloxyethyl)-2,3,4,5-tetrahydropyridin-6-amine
CID 104760120
4-(2,3,4,5-tetrahydropyridin-6-ylamino)butan-2-ol
CID 79503813

Frequently Asked Questions

What is the IUPAC name of N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine?
The IUPAC name of N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine (CID 139148682) is N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine.
What is the SMILES notation for N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine?
The canonical SMILES for N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine is CC(C)P(NC1=NCCC1)C(C)C.
What is the InChIKey of N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine?
The InChIKey is CEIWRBKLYWLSRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N2P/c1-8(2)13(9(3)4)12-10-6-5-7-11-10/h8-9H,5-7H2,1-4H3,(H,11,12).
What are the key properties of N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine?
N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine has a molecular weight of 200.27 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-di(propan-2-yl)phosphanyl-3,4-dihydro-2H-pyrrol-5-amine is sourced from PubChem (CID 139148682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).